N-[1-[3-[4-(3-methylphenyl)piperazin-1-yl]propylamino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[3-[4-(3-methylphenyl)piperazin-1-yl]propylamino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-methyl-2-[3-[4-(m-tolyl)piperazin-1-yl]propylamino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-[3-[4-(3-methylphenyl)-1-piperazinyl]propylamino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[3-[4-(3-methylphenyl)piperazin-1-yl]propylamino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-keto-1-methyl-2-[3-[4-(m-tolyl)piperazino]propylamino]ethyl]thiophene-2-carboxamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C(C)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C(C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H30N4O2S/c1-17-6-3-7-19(16-17)26-13-11-25(12-14-26)10-5-9-23-21(27)18(2)24-22(28)20-8-4-15-29-20/h3-4,6-8,15-16,18H,5,9-14H2,1-2H3,(H,23,27)(H,24,28)