1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-(4-ethoxyphenyl)-1-ethyl-thiourea

Systemtic Name: 1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-(4-ethoxyphenyl)-1-ethyl-thiourea Openeye Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(4-ethoxyphenyl)-1-ethyl-thiourea CAS Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(4-ethoxyphenyl)-1-ethylthiourea IUPAC Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(4-ethoxyphenyl)-1-ethylthiourea Traditional Name: 1-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-1-ethyl-3-p-phenetyl-thiourea Formula: C20H21ClN4O2S MolecularWeight: 416.92434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C20H21ClN4O2S/c1-3-25(20(28)22-14-6-8-15(9-7-14)27-4-2)12-18-23-17-11-13(21)5-10-16(17)19(26)24-18/h5-11H,3-4,12H2,1-2H3,(H,22,28)(H,23,24,26)