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

Systemtic Name: 3-(3-methylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-(m-tolyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-(3-methylphenyl)-1-[[(2R)-2-oxolanyl]methyl]-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-(3-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-(m-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=C1)NC(=S)N(CC2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(C[C@H]2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H24N4O2S/c1-15-6-4-7-16(12-15)23-22(29)26(13-17-8-5-11-28-17)14-20-24-19-10-3-2-9-18(19)21(27)25-20/h2-4,6-7,9-10,12,17H,5,8,11,13-14H2,1H3,(H,23,29)(H,24,25,27)/t17-/m1/s1