3-(2-methylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 3-(2-methylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-(o-tolyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-(2-methylphenyl)-1-[[(2R)-2-oxolanyl]methyl]-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-(2-methylphenyl)-1-[[(2R)-oxolan-2-yl]methyl]-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-[(4-keto-1H-quinazolin-2-yl)methyl]-3-(o-tolyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N(CC2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N(C[C@H]2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H24N4O2S/c1-15-7-2-4-10-18(15)24-22(29)26(13-16-8-6-12-28-16)14-20-23-19-11-5-3-9-17(19)21(27)25-20/h2-5,7,9-11,16H,6,8,12-14H2,1H3,(H,24,29)(H,23,25,27)/t16-/m1/s1