1-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-(2,4-dioxo-1H-quinazolin-3-yl)-3-(4-phenoxyphenyl)thiourea CAS Name: 1-(2,4-dioxo-1H-quinazolin-3-yl)-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-(2,4-dioxo-1H-quinazolin-3-yl)-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(2,4-diketo-1H-quinazolin-3-yl)-3-(4-phenoxyphenyl)thiourea Formula: C21H16N4O3S MolecularWeight: 404.44174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NN3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NN3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H16N4O3S/c26-19-17-8-4-5-9-18(17)23-21(27)25(19)24-20(29)22-14-10-12-16(13-11-14)28-15-6-2-1-3-7-15/h1-13H,(H,23,27)(H2,22,24,29)