1-[(2-chloranylquinazolin-4-yl)amino]-3-[1-(2,4-dimethylphenyl)-3-oxidanylidene-propyl]urea

Systemtic Name: 1-[(2-chloranylquinazolin-4-yl)amino]-3-[1-(2,4-dimethylphenyl)-3-oxidanylidene-propyl]urea Openeye Name: 1-[(2-chloroquinazolin-4-yl)amino]-3-[1-(2,4-dimethylphenyl)-3-oxo-propyl]urea CAS Name: 1-[(2-chloro-4-quinazolinyl)amino]-3-[1-(2,4-dimethylphenyl)-3-oxopropyl]urea IUPAC Name: 1-[(2-chloroquinazolin-4-yl)amino]-3-[1-(2,4-dimethylphenyl)-3-oxopropyl]urea Traditional Name: 1-[(2-chloroquinazolin-4-yl)amino]-3-[1-(2,4-dimethylphenyl)-3-keto-propyl]urea Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(CC=O)NC(=O)NNC2=NC(=NC3=CC=CC=C32)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(CC=O)NC(=O)NNC2=NC(=NC3=CC=CC=C32)Cl)C

InChI

InChI=1S/C20H20ClN5O2/c1-12-7-8-14(13(2)11-12)17(9-10-27)23-20(28)26-25-18-15-5-3-4-6-16(15)22-19(21)24-18/h3-8,10-11,17H,9H2,1-2H3,(H,22,24,25)(H2,23,26,28)