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

Systemtic Name: 1-(2-methoxyethyl)-3-(3-methoxyphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 1-(2-methoxyethyl)-3-(3-methoxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 1-(2-methoxyethyl)-3-(3-methoxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-(3-methoxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-methoxyethyl)-3-(3-methoxyphenyl)thiourea Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H22N4O3S/c1-26-11-10-24(20(28)21-14-6-5-7-15(12-14)27-2)13-18-22-17-9-4-3-8-16(17)19(25)23-18/h3-9,12H,10-11,13H2,1-2H3,(H,21,28)(H,22,23,25)