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

Systemtic Name: N-(azepan-1-ylcarbothioyl)-4-phenoxy-butanamide Openeye Name: N-(azepane-1-carbothioyl)-4-phenoxy-butanamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-4-phenoxybutanamide IUPAC Name: N-(azepane-1-carbothioyl)-4-phenoxybutanamide Traditional Name: N-(azepane-1-carbothioyl)-4-phenoxy-butyramide Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=S)NC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C17H24N2O2S/c20-16(11-8-14-21-15-9-4-3-5-10-15)18-17(22)19-12-6-1-2-7-13-19/h3-5,9-10H,1-2,6-8,11-14H2,(H,18,20,22)