(4E)-5-butyl-1-(4-fluorophenyl)sulfanyl-4-hydroxyimino-7-methyl-6-piperidin-1-yl-5,6-dihydropyrrolo[2,3-c]azepin-8-one

Systemtic Name: (4E)-5-butyl-1-(4-fluorophenyl)sulfanyl-4-hydroxyimino-7-methyl-6-piperidin-1-yl-5,6-dihydropyrrolo[2,3-c]azepin-8-one Openeye Name: (4E)-5-butyl-1-(4-fluorophenyl)sulfanyl-4-hydroxyimino-7-methyl-6-(1-piperidyl)-5,6-dihydropyrrolo[2,3-c]azepin-8-one CAS Name: (4E)-5-butyl-1-[(4-fluorophenyl)thio]-4-hydroxyimino-7-methyl-6-(1-piperidinyl)-5,6-dihydropyrrolo[2,3-c]azepin-8-one IUPAC Name: (4E)-5-butyl-1-(4-fluorophenyl)sulfanyl-4-hydroxyimino-7-methyl-6-piperidin-1-yl-5,6-dihydropyrrolo[2,3-c]azepin-8-one Traditional Name: (4E)-5-butyl-1-[(4-fluorophenyl)thio]-4-hydroximino-7-methyl-6-piperidino-5,6-dihydropyrrol[2,3-c]azepin-8-one Formula: C24H31FN4O2S MolecularWeight: 458.591943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(N(C(=O)C2=C(C1=NO)C=CN2SC3=CC=C(C=C3)F)C)N4CCCCC4

Isomeric SMILES

CCCCC\1C(N(C(=O)C2=C(/C1=N/O)C=CN2SC3=CC=C(C=C3)F)C)N4CCCCC4

InChI

InChI=1S/C24H31FN4O2S/c1-3-4-8-20-21(26-31)19-13-16-29(32-18-11-9-17(25)10-12-18)22(19)24(30)27(2)23(20)28-14-6-5-7-15-28/h9-13,16,20,23,31H,3-8,14-15H2,1-2H3/b26-21-