N-(azepan-1-ylcarbothioyl)-4-(4-methylphenoxy)butanamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-4-(4-methylphenoxy)butanamide Openeye Name: N-(azepane-1-carbothioyl)-4-(4-methylphenoxy)butanamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-4-(4-methylphenoxy)butanamide IUPAC Name: N-(azepane-1-carbothioyl)-4-(4-methylphenoxy)butanamide Traditional Name: N-(azepane-1-carbothioyl)-4-(4-methylphenoxy)butyramide Formula: C18H26N2O2S MolecularWeight: 334.47624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O2S/c1-15-8-10-16(11-9-15)22-14-6-7-17(21)19-18(23)20-12-4-2-3-5-13-20/h8-11H,2-7,12-14H2,1H3,(H,19,21,23)