3-(4-chlorophenyl)sulfanyl-1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]butan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]butan-1-one Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]butan-1-one CAS Name: 3-[(4-chlorophenyl)thio]-1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-1-butanone IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]butan-1-one Traditional Name: 3-[(4-chlorophenyl)thio]-1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]butan-1-one Formula: C24H27ClN4O2S MolecularWeight: 471.01478

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCCN(CC1)CC2=NOC(=N2)C3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(CC(=O)N1CCCN(CC1)CC2=NOC(=N2)C3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H27ClN4O2S/c1-18(32-21-10-8-20(25)9-11-21)16-23(30)29-13-5-12-28(14-15-29)17-22-26-24(31-27-22)19-6-3-2-4-7-19/h2-4,6-11,18H,5,12-17H2,1H3