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

Systemtic Name: 1-(2-methoxyethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-phenethyl-thiourea Openeye Name: 1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-phenethylthiourea IUPAC Name: 1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-phenethylthiourea Traditional Name: 1-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-methoxyethyl)-3-phenethyl-thiourea Formula: C21H24N4O2S MolecularWeight: 396.50586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S/c1-27-14-13-25(21(28)22-12-11-16-7-3-2-4-8-16)15-19-23-18-10-6-5-9-17(18)20(26)24-19/h2-10H,11-15H2,1H3,(H,22,28)(H,23,24,26)