3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[2-(3-methylphenyl)ethyl]propanamide

Systemtic Name: 3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[2-(3-methylphenyl)ethyl]propanamide Openeye Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[2-(m-tolyl)ethyl]propanamide CAS Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[2-(3-methylphenyl)ethyl]propanamide IUPAC Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[2-(3-methylphenyl)ethyl]propanamide Traditional Name: 3-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[2-(m-tolyl)ethyl]propionamide Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCNC(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CCNC(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C20H21ClN2O5S/c1-13-3-2-4-14(9-13)5-7-22-19(24)6-8-29(26,27)18-11-17-16(10-15(18)21)23-20(25)12-28-17/h2-4,9-11H,5-8,12H2,1H3,(H,22,24)(H,23,25)