3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]azepan-2-one

Systemtic Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]azepan-2-one Openeye Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]azepan-2-one CAS Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-2-azepanone IUPAC Name: 3-[[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]azepan-2-one Traditional Name: 3-[[3-(4-chlorobenzyl)-1,2,4-thiadiazol-5-yl]amino]azepan-2-one Formula: C15H17ClN4OS MolecularWeight: 336.83968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=NC(=NS2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=NC(=NS2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H17ClN4OS/c16-11-6-4-10(5-7-11)9-13-19-15(22-20-13)18-12-3-1-2-8-17-14(12)21/h4-7,12H,1-3,8-9H2,(H,17,21)(H,18,19,20)