(3S)-N3-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N3-methyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N3-methyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N3-methyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N3-methylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-N-methylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N'-methyl-piperidine-1,3-dicarboxamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3CCCN(C3)C(=O)N

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)[C@H]3CCCN(C3)C(=O)N

InChI

InChI=1S/C17H22N4O2S/c1-11(15-19-13-7-3-4-8-14(13)24-15)20(2)16(22)12-6-5-9-21(10-12)17(18)23/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H2,18,23)/t11-,12+/m1/s1