N-(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide

Systemtic Name: N-(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide Openeye Name: N-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: N-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-3-[(3,4-dimethylphenyl)thio]propanamide IUPAC Name: N-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=C(C=C3C(=C2)OCC(=O)N3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=C(C=C3C(=C2)OCC(=O)N3)Cl)C

InChI

InChI=1S/C19H19ClN2O3S/c1-11-3-4-13(7-12(11)2)26-6-5-18(23)21-15-9-17-16(8-14(15)20)22-19(24)10-25-17/h3-4,7-9H,5-6,10H2,1-2H3,(H,21,23)(H,22,24)