Suricapavir

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C41H29ClF9N9O4S
Molecular Weight	950.23
Optical Activity	UNSPECIFIED
Additional Stereochemistry	Yes
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0
Stereo Comments	AXIAL, R

SHOW SMILES / InChI

Structure Search

SMILES

CN1N=C(NS(C)(=O)=O)C2=C1C(=CC=C2Cl)N3C(=O)C4=C(C=C(C=C4)C5=CC=CC(=N5)C(F)(F)F)N=C3[C@H](CC6=CC(F)=CC(F)=C6)NC(=O)CN7N=C(C(F)F)C8=C7C(F)(F)[C@@H]9C[C@H]89

InChI

InChIKey=CHCWDBMFOLTXQX-OBTVHEKISA-N

InChI=1S/C41H29ClF9N9O4S/c1-58-34-28(9-8-24(42)32(34)37(56-58)57-65(2,63)64)60-38(54-26-13-18(6-7-21(26)39(60)62)25-4-3-5-29(52-25)41(49,50)51)27(12-17-10-19(43)14-20(44)11-17)53-30(61)16-59-35-31(33(55-59)36(45)46)22-15-23(22)40(35,47)48/h3-11,13-14,22-23,27,36H,12,15-16H2,1-2H3,(H,53,61)(H,56,57)/t22-,23+,27-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Suricapavir

Official Name

English

1H-Cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-acetamide, N-[(1S)-1-[(3S)-3-[4-chloro-1-methyl-3-[(methylsulfonyl)amino]-1H-indazol-7-yl]-3,4-dihydro-4-oxo-7-[6-(trifluoromethyl)-2-pyridinyl]-2-quinazolinyl]-2-(3,5-difluorophenyl)ethyl]-3-(difluoromethyl)

Preferred Name

English

N-[(1S)-1-{(3P)-3-[4-chloro-3-(methanesulfonamido)-1-methyl-1Hindazol-7-yl]-4-oxo-7-[6-(trifluoromethyl)pyridin-2-yl]-3,4-dihydroquinazolin-2-yl}-2-(3,5-difluorophenyl)ethyl]-2-[(3bS,4aR)-3-(difluoromethyl)-5,5-difluoro-3b,4,4a,5-tetrahydro-1Hcyclopropa[

Systematic Name

English

suricapavir [INN]

Common Name

English

(3bS,4aR)-N-[(1S)-1-[(3S)-3-[4-Chloro-1-methyl-3-[(methylsulfonyl)amino]-1H-indazol-7-yl]-3,4-dihydro-4-oxo-7-[6-(trifluoromethyl)-2-pyridinyl]-2-quinazolinyl]-2-(3,5-difluorophenyl)ethyl]-3-(difluoromethyl)-5,5-difluoro-3b,4,4a,5-tetrahydro-1H-cycloprop

Systematic Name

English

Code System Code Type Description

NCI_THESAURUS

C211835