3-(2,4-dimethoxyphenyl)-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(2,4-dimethoxyphenyl)-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(2,4-dimethoxyphenyl)-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-(2,4-dimethoxyphenyl)-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(2,4-dimethoxyphenyl)-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethoxyphenyl)-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-1-(2-thenyl)thiourea Formula: C26H27N3O3S2 MolecularWeight: 493.64088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CS3)C(=S)NC4=C(C=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CS3)C(=S)NC4=C(C=C(C=C4)OC)OC)C

InChI

InChI=1S/C26H27N3O3S2/c1-16-10-17(2)21-12-18(25(30)27-23(21)11-16)14-29(15-20-6-5-9-34-20)26(33)28-22-8-7-19(31-3)13-24(22)32-4/h5-13H,14-15H2,1-4H3,(H,27,30)(H,28,33)