N-[4-oxidanylidene-3-[(4-phenylphenyl)methyl]-2-propyl-quinazolin-6-yl]thiophene-2-carboxamide

Systemtic Name: N-[4-oxidanylidene-3-[(4-phenylphenyl)methyl]-2-propyl-quinazolin-6-yl]thiophene-2-carboxamide Openeye Name: N-[4-oxo-3-[(4-phenylphenyl)methyl]-2-propyl-quinazolin-6-yl]thiophene-2-carboxamide CAS Name: N-[4-oxo-3-[(4-phenylphenyl)methyl]-2-propyl-6-quinazolinyl]-2-thiophenecarboxamide IUPAC Name: N-[4-oxo-3-[(4-phenylphenyl)methyl]-2-propylquinazolin-6-yl]thiophene-2-carboxamide Traditional Name: N-[4-keto-3-(4-phenylbenzyl)-2-propyl-quinazolin-6-yl]thiophene-2-carboxamide Formula: C29H25N3O2S MolecularWeight: 479.5927

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CS3)C(=O)N1CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CS3)C(=O)N1CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3O2S/c1-2-7-27-31-25-16-15-23(30-28(33)26-10-6-17-35-26)18-24(25)29(34)32(27)19-20-11-13-22(14-12-20)21-8-4-3-5-9-21/h3-6,8-18H,2,7,19H2,1H3,(H,30,33)