(3S)-N3-(6-methoxy-1,3-benzothiazol-2-yl)-N1-phenyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-(6-methoxy-1,3-benzothiazol-2-yl)-N1-phenyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-(6-methoxy-1,3-benzothiazol-2-yl)-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-(6-methoxy-1,3-benzothiazol-2-yl)-N1-phenylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-(6-methoxy-1,3-benzothiazol-2-yl)-1-N-phenylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-(6-methoxy-1,3-benzothiazol-2-yl)-N-phenyl-piperidine-1,3-dicarboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H]3CCCN(C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3S/c1-28-16-9-10-17-18(12-16)29-20(23-17)24-19(26)14-6-5-11-25(13-14)21(27)22-15-7-3-2-4-8-15/h2-4,7-10,12,14H,5-6,11,13H2,1H3,(H,22,27)(H,23,24,26)/t14-/m0/s1