1-(3-chlorophenyl)-3-(4,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)urea

Systemtic Name: 1-(3-chlorophenyl)-3-(4,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)urea Openeye Name: 1-(3-chlorophenyl)-3-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)urea CAS Name: 1-(3-chlorophenyl)-3-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)urea IUPAC Name: 1-(3-chlorophenyl)-3-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)urea Traditional Name: 1-(3-chlorophenyl)-3-(5-keto-4,7,7-trimethyl-6,8-dihydroquinazolin-2-yl)urea Formula: C18H19ClN4O2 MolecularWeight: 358.82206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)NC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)NC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H19ClN4O2/c1-10-15-13(8-18(2,3)9-14(15)24)22-16(20-10)23-17(25)21-12-6-4-5-11(19)7-12/h4-7H,8-9H2,1-3H3,(H2,20,21,22,23,25)