1-[[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]amino]-3-phenyl-thiourea Openeye Name: 1-[[4-oxo-3-(p-tolyl)quinazolin-2-yl]amino]-3-phenyl-thiourea CAS Name: 1-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]amino]-3-phenylthiourea IUPAC Name: 1-[[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]amino]-3-phenylthiourea Traditional Name: 1-[[4-keto-3-(p-tolyl)quinazolin-2-yl]amino]-3-phenyl-thiourea Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2NNC(=S)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2NNC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C22H19N5OS/c1-15-11-13-17(14-12-15)27-20(28)18-9-5-6-10-19(18)24-21(27)25-26-22(29)23-16-7-3-2-4-8-16/h2-14H,1H3,(H,24,25)(H2,23,26,29)