[(3S)-3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [(3S)-3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]-thiophen-2-yl-methanone Openeye Name: [(3S)-3-(3,4-dimethylanilino)-1-piperidyl]-(2-thienyl)methanone CAS Name: [(3S)-3-(3,4-dimethylanilino)-1-piperidinyl]-thiophen-2-ylmethanone IUPAC Name: [(3S)-3-(3,4-dimethylanilino)piperidin-1-yl]-thiophen-2-ylmethanone Traditional Name: [(3S)-3-(3,4-dimethylanilino)piperidino]-(2-thienyl)methanone Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CCCN(C2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C18H22N2OS/c1-13-7-8-15(11-14(13)2)19-16-5-3-9-20(12-16)18(21)17-6-4-10-22-17/h4,6-8,10-11,16,19H,3,5,9,12H2,1-2H3/t16-/m0/s1