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

Systemtic Name: N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-3-phenylsulfanyl-propanamide Openeye Name: N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-phenylsulfanyl-propanamide CAS Name: N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(phenylthio)propanamide IUPAC Name: N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-phenylsulfanylpropanamide Traditional Name: N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]-3-(phenylthio)propionamide Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3S/c1-12-18(22)20-15-11-13(7-8-16(15)23-12)19-17(21)9-10-24-14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H,19,21)(H,20,22)/t12-/m0/s1