1-(2-cyanophenyl)-3-[2-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-4-yl]urea

Systemtic Name: 1-(2-cyanophenyl)-3-[2-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-4-yl]urea Openeye Name: 1-(2-cyanophenyl)-3-[2-oxo-3-(2-thienylmethyl)quinazolin-4-yl]urea CAS Name: 1-(2-cyanophenyl)-3-[2-oxo-3-(thiophen-2-ylmethyl)-4-quinazolinyl]urea IUPAC Name: 1-(2-cyanophenyl)-3-[2-oxo-3-(thiophen-2-ylmethyl)quinazolin-4-yl]urea Traditional Name: 1-(2-cyanophenyl)-3-[2-keto-3-(2-thenyl)quinazolin-4-yl]urea Formula: C21H15N5O2S MolecularWeight: 401.4411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=O)NC2=C3C=CC=CC3=NC(=O)N2CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=O)NC2=C3C=CC=CC3=NC(=O)N2CC4=CC=CS4

InChI

InChI=1S/C21H15N5O2S/c22-12-14-6-1-3-9-17(14)23-20(27)25-19-16-8-2-4-10-18(16)24-21(28)26(19)13-15-7-5-11-29-15/h1-11H,13H2,(H2,23,25,27)