6-chloranyl-3-[(3-cyanophenyl)amino]-N-pyrimidin-5-yl-1,2-benzoxazole-7-carboxamide

Systemtic Name: 6-chloranyl-3-[(3-cyanophenyl)amino]-N-pyrimidin-5-yl-1,2-benzoxazole-7-carboxamide Openeye Name: 6-chloro-3-(3-cyanoanilino)-N-pyrimidin-5-yl-1,2-benzoxazole-7-carboxamide CAS Name: 6-chloro-3-(3-cyanoanilino)-N-(5-pyrimidinyl)-1,2-benzoxazole-7-carboxamide IUPAC Name: 6-chloro-3-(3-cyanoanilino)-N-pyrimidin-5-yl-1,2-benzoxazole-7-carboxamide Traditional Name: 6-chloro-3-(3-cyanoanilino)-N-(5-pyrimidyl)indoxazene-7-carboxamide Formula: C19H11ClN6O2 MolecularWeight: 390.78264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NOC3=C2C=CC(=C3C(=O)NC4=CN=CN=C4)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NOC3=C2C=CC(=C3C(=O)NC4=CN=CN=C4)Cl)C#N

InChI

InChI=1S/C19H11ClN6O2/c20-15-5-4-14-17(16(15)19(27)25-13-8-22-10-23-9-13)28-26-18(14)24-12-3-1-2-11(6-12)7-21/h1-6,8-10H,(H,24,26)(H,25,27)