3-(furan-2-ylmethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-phenethyl-thiourea

Systemtic Name: 3-(furan-2-ylmethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-phenethyl-thiourea Openeye Name: 3-(2-furylmethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-phenethyl-thiourea CAS Name: 3-(2-furanylmethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-phenethylthiourea IUPAC Name: 3-(furan-2-ylmethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-phenethylthiourea Traditional Name: 3-(2-furfuryl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]-1-phenethyl-thiourea Formula: C23H22N4O2S MolecularWeight: 418.51138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=NC(=O)C3=CC=CC=C3N2)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=NC(=O)C3=CC=CC=C3N2)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C23H22N4O2S/c28-22-19-10-4-5-11-20(19)25-21(26-22)16-27(13-12-17-7-2-1-3-8-17)23(30)24-15-18-9-6-14-29-18/h1-11,14H,12-13,15-16H2,(H,24,30)(H,25,26,28)