(2S)-N-(2-methoxy-5-methyl-phenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propanamide

Systemtic Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propanamide Openeye Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-[4-(3-thienylmethyl)piperazin-1-yl]propanamide CAS Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-[4-(3-thiophenylmethyl)-1-piperazinyl]propanamide IUPAC Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propanamide Traditional Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-[4-(3-thenyl)piperazino]propionamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)N2CCN(CC2)CC3=CSC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C)N2CCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C20H27N3O2S/c1-15-4-5-19(25-3)18(12-15)21-20(24)16(2)23-9-7-22(8-10-23)13-17-6-11-26-14-17/h4-6,11-12,14,16H,7-10,13H2,1-3H3,(H,21,24)/t16-/m0/s1