3-azanyl-N-[4-[(2R)-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-azanyl-N-[4-[(2R)-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl]propanamide Openeye Name: 3-amino-N-[4-[(2R)-2,4-dimethyl-3-oxo-1,4-benzoxazin-6-yl]thiazol-2-yl]propanamide CAS Name: 3-amino-N-[4-[(2R)-2,4-dimethyl-3-oxo-1,4-benzoxazin-6-yl]-2-thiazolyl]propanamide IUPAC Name: 3-amino-N-[4-[(2R)-2,4-dimethyl-3-oxo-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl]propanamide Traditional Name: 3-amino-N-[4-[(2R)-3-keto-2,4-dimethyl-1,4-benzoxazin-6-yl]thiazol-2-yl]propionamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C3=CSC(=N3)NC(=O)CCN)C

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C3=CSC(=N3)NC(=O)CCN)C

InChI

InChI=1S/C16H18N4O3S/c1-9-15(22)20(2)12-7-10(3-4-13(12)23-9)11-8-24-16(18-11)19-14(21)5-6-17/h3-4,7-9H,5-6,17H2,1-2H3,(H,18,19,21)/t9-/m1/s1