3-[2-cyano-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-2-oxidanylidene-1,4-dihydroquinazoline-7-carbonitrile

Systemtic Name: 3-[2-cyano-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-2-oxidanylidene-1,4-dihydroquinazoline-7-carbonitrile Openeye Name: 3-[2-cyano-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-2-oxo-1,4-dihydroquinazoline-7-carbonitrile CAS Name: 3-[2-cyano-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-2-oxo-1,4-dihydroquinazoline-7-carbonitrile IUPAC Name: 3-[2-cyano-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-2-oxo-1,4-dihydroquinazoline-7-carbonitrile Traditional Name: 3-[2-cyano-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-2-keto-1,4-dihydroquinazoline-7-carbonitrile Formula: C25H19N5O3S MolecularWeight: 469.51506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC(=C(C=C3)C#N)N4CC5=C(C=C(C=C5)C#N)NC4=O

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC(=C(C=C3)C#N)N4CC5=C(C=C(C=C5)C#N)NC4=O

InChI

InChI=1S/C25H19N5O3S/c26-14-17-7-8-20-16-29(25(31)28-22(20)12-17)24-13-21(10-9-19(24)15-27)34(32,33)30-11-3-5-18-4-1-2-6-23(18)30/h1-2,4,6-10,12-13H,3,5,11,16H2,(H,28,31)