N-[1-(2-methoxy-5-methyl-phenyl)ethyl]-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[1-(2-methoxy-5-methyl-phenyl)ethyl]-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[1-(2-methoxy-5-methyl-phenyl)ethyl]-4-oxo-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[1-(2-methoxy-5-methylphenyl)ethyl]-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[1-(2-methoxy-5-methylphenyl)ethyl]-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-[1-(2-methoxy-5-methyl-phenyl)ethyl]-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3S/c1-15-9-12-22(31-3)20(13-15)16(2)26-23(29)17-10-11-19-21(14-17)27-25(32)28(24(19)30)18-7-5-4-6-8-18/h4-14,16H,1-3H3,(H,26,29)(H,27,32)