4-(5-methylthiophen-2-yl)-4-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]butanamide

Systemtic Name: 4-(5-methylthiophen-2-yl)-4-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]butanamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-4-(5-methyl-2-thienyl)-4-oxo-butanamide CAS Name: 4-(5-methyl-2-thiophenyl)-4-oxo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]butanamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-4-(5-methylthiophen-2-yl)-4-oxobutanamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-4-keto-4-(5-methyl-2-thienyl)butyramide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2S/c1-19-8-10-22(29-19)21(27)9-11-23(28)24-12-5-13-25-14-16-26(17-15-25)18-20-6-3-2-4-7-20/h2-4,6-8,10H,5,9,11-18H2,1H3,(H,24,28)