1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-isopropylphenyl)thiourea CAS Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-1-ethyl-3-p-cumenyl-thiourea Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H23ClN4OS/c1-4-26(21(28)23-16-8-5-14(6-9-16)13(2)3)12-19-24-18-11-15(22)7-10-17(18)20(27)25-19/h5-11,13H,4,12H2,1-3H3,(H,23,28)(H,24,25,27)