(2S)-N-(3-chloranyl-4-methoxy-phenyl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-(3-chloranyl-4-methoxy-phenyl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-(3-chloro-4-methoxy-phenyl)-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]propanamide CAS Name: (2S)-N-(3-chloro-4-methoxyphenyl)-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]propanamide IUPAC Name: (2S)-N-(3-chloro-4-methoxyphenyl)-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]propanamide Traditional Name: (2S)-N-(3-chloro-4-methoxy-phenyl)-2-[4-(2-thenoyl)piperazino]propionamide Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)Cl)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)OC)Cl)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H22ClN3O3S/c1-13(18(24)21-14-5-6-16(26-2)15(20)12-14)22-7-9-23(10-8-22)19(25)17-4-3-11-27-17/h3-6,11-13H,7-10H2,1-2H3,(H,21,24)/t13-/m0/s1