2-(4-chlorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]thiazole-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[3-(2-ketoazepan-1-yl)propyl]thiazole-4-carboxamide Formula: C19H22ClN3O2S MolecularWeight: 391.91488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O2S/c20-15-8-6-14(7-9-15)19-22-16(13-26-19)18(25)21-10-4-12-23-11-3-1-2-5-17(23)24/h6-9,13H,1-5,10-12H2,(H,21,25)