N-(2-cyclopentylsulfanylphenyl)-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[2-(cyclopentylthio)phenyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-3-(3-keto-1,4-benzoxazin-4-yl)propionamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=CC=C2NC(=O)CCN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

C1CCC(C1)SC2=CC=CC=C2NC(=O)CCN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C22H24N2O3S/c25-21(13-14-24-18-10-4-5-11-19(18)27-15-22(24)26)23-17-9-3-6-12-20(17)28-16-7-1-2-8-16/h3-6,9-12,16H,1-2,7-8,13-15H2,(H,23,25)