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

Systemtic Name: 3-acetamido-N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-3-(2-thienyl)propionamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CC(C3=CC=CS3)NC(=O)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CC(C3=CC=CS3)NC(=O)C)C

InChI

InChI=1S/C22H30N4O2S/c1-4-25-9-11-26(12-10-25)20-8-7-18(14-16(20)2)24-22(28)15-19(23-17(3)27)21-6-5-13-29-21/h5-8,13-14,19H,4,9-12,15H2,1-3H3,(H,23,27)(H,24,28)