N-[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide

Systemtic Name: N-[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide Openeye Name: N-[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide CAS Name: N-[4-(5-acetamido-3-methyl-1-pyrazolyl)phenyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide IUPAC Name: N-[4-(5-acetamido-3-methylpyrazol-1-yl)phenyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide Traditional Name: N-[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]-3-keto-4H-1,4-benzoxazine-7-carboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)NC(=O)CO4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)NC(=O)CO4

InChI

InChI=1S/C21H19N5O4/c1-12-9-19(22-13(2)27)26(25-12)16-6-4-15(5-7-16)23-21(29)14-3-8-17-18(10-14)30-11-20(28)24-17/h3-10H,11H2,1-2H3,(H,22,27)(H,23,29)(H,24,28)