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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=NC(=O)C3=CC=CC=C3N2)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](OC1)CN(CC2=NC(=O)C3=CC=CC=C3N2)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2S/c27-21-18-10-4-5-11-19(18)24-20(25-21)15-26(14-17-9-6-12-28-17)22(29)23-13-16-7-2-1-3-8-16/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,23,29)(H,24,25,27)/t17-/m1/s1