3-(4-methoxyphenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-methoxyphenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-methoxyphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-methoxyphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-methoxyphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(3-pyridylmethyl)thiourea Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CN=CC=C3)C(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CN=CC=C3)C(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H24N4O2S/c1-17-5-3-7-19-13-20(24(30)28-23(17)19)16-29(15-18-6-4-12-26-14-18)25(32)27-21-8-10-22(31-2)11-9-21/h3-14H,15-16H2,1-2H3,(H,27,32)(H,28,30)