N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxidanylidene-3-thiophen-3-yl-propanamide

Systemtic Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxidanylidene-3-thiophen-3-yl-propanamide Openeye Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxo-3-(3-thienyl)propanamide CAS Name: N-[3-[4-methyl-1-(4-phenyl-1-piperazinyl)cyclohexyl]phenyl]-2-oxo-3-(3-thiophenyl)propanamide IUPAC Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-2-oxo-3-thiophen-3-ylpropanamide Traditional Name: 2-keto-N-[3-[4-methyl-1-(4-phenylpiperazino)cyclohexyl]phenyl]-3-(3-thienyl)propionamide Formula: C30H35N3O2S MolecularWeight: 501.6828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C(=O)CC3=CSC=C3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C(=O)CC3=CSC=C3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N3O2S/c1-23-10-13-30(14-11-23,33-17-15-32(16-18-33)27-8-3-2-4-9-27)25-6-5-7-26(21-25)31-29(35)28(34)20-24-12-19-36-22-24/h2-9,12,19,21-23H,10-11,13-18,20H2,1H3,(H,31,35)