3-(4-ethylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-(4-ethylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(4-ethylphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(4-ethylphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4-ethylphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-benzyl-3-(4-ethylphenyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]thiourea Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H24N4OS/c1-2-18-12-14-20(15-13-18)26-25(31)29(16-19-8-4-3-5-9-19)17-23-27-22-11-7-6-10-21(22)24(30)28-23/h3-15H,2,16-17H2,1H3,(H,26,31)(H,27,28,30)