1-[[5-(1,3-benzothiazol-5-ylcarbamoyl)-2-phenyl-phenyl]methyl]piperidine-4-carboxamide hydrochloride

Systemtic Name: 1-[[5-(1,3-benzothiazol-5-ylcarbamoyl)-2-phenyl-phenyl]methyl]piperidine-4-carboxamide hydrochloride Openeye Name: 1-[[5-(1,3-benzothiazol-5-ylcarbamoyl)-2-phenyl-phenyl]methyl]piperidine-4-carboxamide hydrochloride CAS Name: 1-[[5-[(1,3-benzothiazol-5-ylamino)-oxomethyl]-2-phenylphenyl]methyl]-4-piperidinecarboxamide hydrochloride IUPAC Name: 1-[[5-(1,3-benzothiazol-5-ylcarbamoyl)-2-phenylphenyl]methyl]piperidine-4-carboxamide hydrochloride Traditional Name: 1-[5-(1,3-benzothiazol-5-ylcarbamoyl)-2-phenyl-benzyl]isonipecotamide hydrochloride Formula: C27H27ClN4O2S MolecularWeight: 507.04688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC2=C(C=CC(=C2)C(=O)NC3=CC4=C(C=C3)SC=N4)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)CC2=C(C=CC(=C2)C(=O)NC3=CC4=C(C=C3)SC=N4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H26N4O2S.ClH/c28-26(32)19-10-12-31(13-11-19)16-21-14-20(6-8-23(21)18-4-2-1-3-5-18)27(33)30-22-7-9-25-24(15-22)29-17-34-25;/h1-9,14-15,17,19H,10-13,16H2,(H2,28,32)(H,30,33);1H