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

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-isobutyl-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-isobutyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)thiourea Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O3S/c1-15(2)11-25-23(31)27(13-16-6-5-7-24-12-16)14-18-8-17-9-20(29-3)21(30-4)10-19(17)26-22(18)28/h5-10,12,15H,11,13-14H2,1-4H3,(H,25,31)(H,26,28)