3-(4-chlorophenyl)sulfanyl-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]propionamide Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN2O3S/c1-11-18(23)21-15-10-13(4-7-16(15)24-11)20-17(22)8-9-25-14-5-2-12(19)3-6-14/h2-7,10-11H,8-9H2,1H3,(H,20,22)(H,21,23)/t11-/m0/s1