3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)propionamide Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCSCC(=O)N

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCSCC(=O)N

InChI

InChI=1S/C14H17N3O4S/c1-8-14(20)17-10-6-9(2-3-11(10)21-8)16-13(19)4-5-22-7-12(15)18/h2-3,6,8H,4-5,7H2,1H3,(H2,15,18)(H,16,19)(H,17,20)