OPELCONAZOLE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C38H37F3N6O3
Molecular Weight	682.734
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=C(OC[C@@H]2CO[C@](CN3C=NC=N3)(C2)C4=C(F)C=C(F)C=C4)C=CC(=C1)N5CCN(CC5)C6=CC=C(C=C6)C(=O)NC7=CC=C(F)C=C7

InChI

InChIKey=OSAMZQJKSCAOHA-CWRQMEKBSA-N

InChI=1S/C38H37F3N6O3/c1-26-18-33(46-16-14-45(15-17-46)32-9-2-28(3-10-32)37(48)44-31-7-4-29(39)5-8-31)11-13-36(26)49-21-27-20-38(50-22-27,23-47-25-42-24-43-47)34-12-6-30(40)19-35(34)41/h2-13,18-19,24-25,27H,14-17,20-23H2,1H3,(H,44,48)/t27-,38+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C38H37F3N6O3
Molecular Weight	682.734
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:35:05 GMT 2023` Edited by `admin` on `Sat Dec 16 18:35:05 GMT 2023`
Record UNII	45LU8Q6ASU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OPELCONAZOLE

Official Name

English

OPELCONAZOLE(INN)

Common Name

English

OPELCONAZOLE [USAN]

Common Name

English

D-THREO-PENTITOL, 2,5-ANHYDRO-1,3,4-TRIDEOXY-2-C-(2,4-DIFLUOROPHENYL)-4-((4-(4-(4-(((4-FLUOROPHENYL)AMINO)CARBONYL)PHENYL)-1-PIPERAZINYL)-2-METHYLPHENOXY)METHYL)-1-(1H-1,2,4-TRIAZOL-1-YL)-

Systematic Name

English

4-(4-(4-(((3R,5R)-5-((1H-1,2,4-TRIAZOL-1-YL)METHYL)-5-(2,4-DIFLUOROPHENYL)TETRAHYDROFURAN-3-YL)METHOXY)-3-METHYLPHENYL)PIPERAZIN-1-YL)-N-(4-FLUOROPHENYL)BENZAMIDE

Systematic Name

English

PC-945

Code

English

PC945

Code

English

Classification Tree Code System Code

FDA ORPHAN DRUG

824121