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

Systemtic Name: 1-[3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[3-(3-methyl-4-oxo-quinazolin-2-yl)propanoylamino]thiourea CAS Name: 1-[[3-(3-methyl-4-oxo-2-quinazolinyl)-1-oxopropyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[3-(3-methyl-4-oxoquinazolin-2-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[3-(4-keto-3-methyl-quinazolin-2-yl)propanoylamino]-3-p-cumenyl-thiourea Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C22H25N5O2S/c1-14(2)15-8-10-16(11-9-15)23-22(30)26-25-20(28)13-12-19-24-18-7-5-4-6-17(18)21(29)27(19)3/h4-11,14H,12-13H2,1-3H3,(H,25,28)(H2,23,26,30)