3-phenyl-2-(propylamino)-1,4-thiazepan-5-one

Systemtic Name: 3-phenyl-2-(propylamino)-1,4-thiazepan-5-one Openeye Name: 3-phenyl-2-(propylamino)-1,4-thiazepan-5-one CAS Name: 3-phenyl-2-(propylamino)-1,4-thiazepan-5-one IUPAC Name: 3-phenyl-2-(propylamino)-1,4-thiazepan-5-one Traditional Name: 3-phenyl-2-(propylamino)-1,4-thiazepan-5-one Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1C(NC(=O)CCS1)C2=CC=CC=C2

Isomeric SMILES

CCCNC1C(NC(=O)CCS1)C2=CC=CC=C2

InChI

InChI=1S/C14H20N2OS/c1-2-9-15-14-13(11-6-4-3-5-7-11)16-12(17)8-10-18-14/h3-7,13-15H,2,8-10H2,1H3,(H,16,17)