(2R)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]-N-(2-thiophen-2-ylethyl)propanamide

Systemtic Name: (2R)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]-N-(2-thiophen-2-ylethyl)propanamide Openeye Name: (2R)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]-N-[2-(2-thienyl)ethyl]propanamide CAS Name: (2R)-2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]-N-(2-thiophen-2-ylethyl)propanamide IUPAC Name: (2R)-2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]-N-(2-thiophen-2-ylethyl)propanamide Traditional Name: (2R)-2-[4-(2-methoxy-5-methyl-benzyl)piperazino]-N-[2-(2-thienyl)ethyl]propionamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(C)C(=O)NCCC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)[C@H](C)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C22H31N3O2S/c1-17-6-7-21(27-3)19(15-17)16-24-10-12-25(13-11-24)18(2)22(26)23-9-8-20-5-4-14-28-20/h4-7,14-15,18H,8-13,16H2,1-3H3,(H,23,26)/t18-/m1/s1