N-(3-aminocarbonyl-4-chloranyl-phenyl)-1-(1,3-benzothiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4-chloranyl-phenyl)-1-(1,3-benzothiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-yl)-N-(3-carbamoyl-4-chloro-phenyl)piperidine-3-carboxamide CAS Name: 1-(1,3-benzothiazol-2-yl)-N-(3-carbamoyl-4-chlorophenyl)-3-piperidinecarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-N-(3-carbamoyl-4-chlorophenyl)piperidine-3-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-yl)-N-(3-carbamoyl-4-chloro-phenyl)nipecotamide Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)C(=O)NC4=CC(=C(C=C4)Cl)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)C(=O)NC4=CC(=C(C=C4)Cl)C(=O)N

InChI

InChI=1S/C20H19ClN4O2S/c21-15-8-7-13(10-14(15)18(22)26)23-19(27)12-4-3-9-25(11-12)20-24-16-5-1-2-6-17(16)28-20/h1-2,5-8,10,12H,3-4,9,11H2,(H2,22,26)(H,23,27)