N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenyl-methyl]thiophen-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenyl-methyl]thiophen-2-yl]thiophene-2-carboxamide Openeye Name: N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenyl-methyl]-2-thienyl]thiophene-2-carboxamide CAS Name: N-[4,5-dimethyl-3-[(4-methyl-1-piperazinyl)-phenylmethyl]-2-thiophenyl]-2-thiophenecarboxamide IUPAC Name: N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenylmethyl]thiophen-2-yl]thiophene-2-carboxamide Traditional Name: N-[4,5-dimethyl-3-[(4-methylpiperazino)-phenyl-methyl]-2-thienyl]thiophene-2-carboxamide Formula: C23H27N3OS2 MolecularWeight: 425.60998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=CC=C2)N3CCN(CC3)C)NC(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CC=CC=C2)N3CCN(CC3)C)NC(=O)C4=CC=CS4)C

InChI

InChI=1S/C23H27N3OS2/c1-16-17(2)29-23(24-22(27)19-10-7-15-28-19)20(16)21(18-8-5-4-6-9-18)26-13-11-25(3)12-14-26/h4-10,15,21H,11-14H2,1-3H3,(H,24,27)