1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-ethyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)thiourea Formula: C21H24N4O3S MolecularWeight: 412.50526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC1=CN=CC=C1)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

Isomeric SMILES

CCNC(=S)N(CC1=CN=CC=C1)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

InChI

InChI=1S/C21H24N4O3S/c1-4-23-21(29)25(12-14-6-5-7-22-11-14)13-16-8-15-9-18(27-2)19(28-3)10-17(15)24-20(16)26/h5-11H,4,12-13H2,1-3H3,(H,23,29)(H,24,26)