CL-4AS-1

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H33ClN2O2
Molecular Weight	441.005
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@H](C(=O)NC3=C(Cl)C=CC=C3)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])CC[C@@]5([H])N(C)C(=O)C=C[C@]45C

InChI

InChIKey=CTVXDPDUOKQBKZ-GFNRTWGOSA-N

InChI=1S/C26H33ClN2O2/c1-25-14-12-18-16(8-11-22-26(18,2)15-13-23(30)29(22)3)17(25)9-10-19(25)24(31)28-21-7-5-4-6-20(21)27/h4-7,13,15-19,22H,8-12,14H2,1-3H3,(H,28,31)/t16-,17-,18-,19+,22+,25-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H33ClN2O2
Molecular Weight	441.005
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Androgen Receptor 167 Target ID: CHEMBL1871 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19846549	Agonist 2678		12.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:38:14 GMT 2023` Edited by `admin` on `Sat Dec 16 18:38:14 GMT 2023`
Record UNII	24SF5976Y2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CL-4AS-1

Common Name

English

1H-INDENO(5,4-F)QUINOLINE-7-CARBOXAMIDE, N-(2-CHLOROPHENYL)-2,4A,4B,5,6,6A,7,8,9,9A,9B,10,11,11A-TETRADECAHYDRO-1,4A,6A-TRIMETHYL-2-OXO-, (4AR-(4A.ALPHA.,4B.BETA.,6A.ALPHA.,7.ALPHA.,9A.BETA.,9B.ALPHA.,11A.BETA.))-

Systematic Name

English

CL-4AS1

Common Name

English

(4AR,4BS,6AS,7S,9AS,9BS,11AR)-N-(2-CHLOROPHENYL)-2,4A,4B,5,6,6A,7,8,9,9A,9B,10,11,11A-TETRADECAHYDRO-1,4A,6A-TRIMETHYL-2-OXO-1H-INDENO(5,4-F)QUINOLINE-7-CARBOXAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

9932961