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

Systemtic Name: 3-(2-methoxyphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(2-methoxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(2-methoxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(2-methoxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-benzyl-1-[(4-keto-1H-quinazolin-2-yl)methyl]-3-(2-methoxyphenyl)thiourea Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=CC=C1NC(=S)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H22N4O2S/c1-30-21-14-8-7-13-20(21)26-24(31)28(15-17-9-3-2-4-10-17)16-22-25-19-12-6-5-11-18(19)23(29)27-22/h2-14H,15-16H2,1H3,(H,26,31)(H,25,27,29)