(E)-3-(2-chloranylquinolin-3-yl)-2-(6-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2-chloranylquinolin-3-yl)-2-(6-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-chloro-3-quinolyl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2-chloro-3-quinolinyl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(2-chloroquinolin-3-yl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-chloro-3-quinolyl)-2-(4-keto-6-methyl-1H-quinazolin-2-yl)acrylonitrile Formula: C21H13ClN4O MolecularWeight: 372.80712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=CC4=CC=CC=C4N=C3Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=NC2=O)/C(=C/C3=CC4=CC=CC=C4N=C3Cl)/C#N

InChI

InChI=1S/C21H13ClN4O/c1-12-6-7-18-16(8-12)21(27)26-20(25-18)15(11-23)10-14-9-13-4-2-3-5-17(13)24-19(14)22/h2-10H,1H3,(H,25,26,27)/b15-10+