1-[azanyl-[(4,7-dimethylquinazolin-2-yl)amino]methylidene]-3-(3,4-dimethylphenyl)thiourea

Systemtic Name: 1-[azanyl-[(4,7-dimethylquinazolin-2-yl)amino]methylidene]-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-[amino-[(4,7-dimethylquinazolin-2-yl)amino]methylene]-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-[amino-[(4,7-dimethyl-2-quinazolinyl)amino]methylidene]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-[amino-[(4,7-dimethylquinazolin-2-yl)amino]methylidene]-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-[amino-[(4,7-dimethylquinazolin-2-yl)amino]methylene]-3-(3,4-dimethylphenyl)thiourea Formula: C20H22N6S MolecularWeight: 378.49388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)NC(=NC(=S)NC3=CC(=C(C=C3)C)C)N)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)NC(=NC(=S)NC3=CC(=C(C=C3)C)C)N)C

InChI

InChI=1S/C20H22N6S/c1-11-5-8-16-14(4)22-19(24-17(16)9-11)25-18(21)26-20(27)23-15-7-6-12(2)13(3)10-15/h5-10H,1-4H3,(H4,21,22,23,24,25,26,27)