1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-2,4-bis(oxidanylidene)-N-phenethyl-quinazoline-7-carboxamide

Systemtic Name: 1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-2,4-bis(oxidanylidene)-N-phenethyl-quinazoline-7-carboxamide Openeye Name: 1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-2,4-dioxo-N-phenethyl-quinazoline-7-carboxamide CAS Name: 1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-2,4-dioxo-N-phenethyl-7-quinazolinecarboxamide IUPAC Name: 1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-2,4-dioxo-N-phenethylquinazoline-7-carboxamide Traditional Name: 1-(2-cyanobenzyl)-3-(4-ethylphenyl)-2,4-diketo-N-phenethyl-quinazoline-7-carboxamide Formula: C33H28N4O3 MolecularWeight: 528.60042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCCC4=CC=CC=C4)N(C2=O)CC5=CC=CC=C5C#N

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCCC4=CC=CC=C4)N(C2=O)CC5=CC=CC=C5C#N

InChI

InChI=1S/C33H28N4O3/c1-2-23-12-15-28(16-13-23)37-32(39)29-17-14-25(31(38)35-19-18-24-8-4-3-5-9-24)20-30(29)36(33(37)40)22-27-11-7-6-10-26(27)21-34/h3-17,20H,2,18-19,22H2,1H3,(H,35,38)