N-(azepan-1-ylcarbothioyl)-4-methyl-benzamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-4-methyl-benzamide Openeye Name: N-(azepane-1-carbothioyl)-4-methyl-benzamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-4-methylbenzamide IUPAC Name: N-(azepane-1-carbothioyl)-4-methylbenzamide Traditional Name: N-(azepane-1-carbothioyl)-4-methyl-benzamide Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)N2CCCCCC2

InChI

InChI=1S/C15H20N2OS/c1-12-6-8-13(9-7-12)14(18)16-15(19)17-10-4-2-3-5-11-17/h6-9H,2-5,10-11H2,1H3,(H,16,18,19)