1-(3-cyanophenyl)-3-(4-phenylazanylquinazolin-6-yl)thiourea

Systemtic Name: 1-(3-cyanophenyl)-3-(4-phenylazanylquinazolin-6-yl)thiourea Openeye Name: 1-(4-anilinoquinazolin-6-yl)-3-(3-cyanophenyl)thiourea CAS Name: 1-(4-anilino-6-quinazolinyl)-3-(3-cyanophenyl)thiourea IUPAC Name: 1-(4-anilinoquinazolin-6-yl)-3-(3-cyanophenyl)thiourea Traditional Name: 1-(4-anilinoquinazolin-6-yl)-3-(3-cyanophenyl)thiourea Formula: C22H16N6S MolecularWeight: 396.46764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=S)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=S)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H16N6S/c23-13-15-5-4-8-17(11-15)27-22(29)28-18-9-10-20-19(12-18)21(25-14-24-20)26-16-6-2-1-3-7-16/h1-12,14H,(H,24,25,26)(H2,27,28,29)