4-(azepan-1-ylcarbonyl)benzenecarbothioamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)benzenecarbothioamide Openeye Name: 4-(azepane-1-carbonyl)benzenecarbothioamide CAS Name: 4-[1-azepanyl(oxo)methyl]benzenecarbothioamide IUPAC Name: 4-(azepane-1-carbonyl)benzenecarbothioamide Traditional Name: 4-(azepane-1-carbonyl)thiobenzamide Formula: C14H18N2OS MolecularWeight: 262.37052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C14H18N2OS/c15-13(18)11-5-7-12(8-6-11)14(17)16-9-3-1-2-4-10-16/h5-8H,1-4,9-10H2,(H2,15,18)