4-[(cyclopentylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride

Systemtic Name: 4-[(cyclopentylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Openeye Name: 4-[(cyclopentylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride CAS Name: 4-[(cyclopentylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride IUPAC Name: 4-[(cyclopentylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Traditional Name: 4-[(cyclopentylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Formula: C27H28ClN3O2S MolecularWeight: 494.04812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNC5CCCC5.Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNC5CCCC5.Cl

InChI

InChI=1S/C27H27N3O2S.ClH/c1-32-23-16-15-22(19-7-3-2-4-8-19)25-24(23)29-27(33-25)30-26(31)20-13-11-18(12-14-20)17-28-21-9-5-6-10-21;/h2-4,7-8,11-16,21,28H,5-6,9-10,17H2,1H3,(H,29,30,31);1H