1-[2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[[2-(8-methyl-4-oxo-quinazolin-3-yl)acetyl]amino]thiourea CAS Name: 1-[[2-(8-methyl-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[[2-(8-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[[2-(4-keto-8-methyl-quinazolin-3-yl)acetyl]amino]-3-p-cumenyl-thiourea Formula: C21H23N5O2S MolecularWeight: 409.50462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NNC(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NNC(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H23N5O2S/c1-13(2)15-7-9-16(10-8-15)23-21(29)25-24-18(27)11-26-12-22-19-14(3)5-4-6-17(19)20(26)28/h4-10,12-13H,11H2,1-3H3,(H,24,27)(H2,23,25,29)