3-acetamido-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[2-methyl-4-(4-methylpiperazino)phenyl]-3-(2-thienyl)propionamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O2S/c1-15-13-17(25-10-8-24(3)9-11-25)6-7-18(15)23-21(27)14-19(22-16(2)26)20-5-4-12-28-20/h4-7,12-13,19H,8-11,14H2,1-3H3,(H,22,26)(H,23,27)