N-[(diphenylmethylidene)amino]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(diphenylmethylidene)amino]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-(benzhydrylideneamino)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(diphenylmethylene)amino]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(benzhydrylideneamino)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-(benzhydrylideneamino)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H20N4O2S MolecularWeight: 440.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NN=C(C3=CC=CC=C3)C4=CC=CC=C4)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NN=C(C3=CC=CC=C3)C4=CC=CC=C4)NC1=S

InChI

InChI=1S/C25H20N4O2S/c1-2-15-29-24(31)20-14-13-19(16-21(20)26-25(29)32)23(30)28-27-22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h2-14,16H,1,15H2,(H,26,32)(H,28,30)