1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethylphenyl)-1-[(2-keto-6,7-dimethoxy-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(=C(C=C1)NC(=S)N(CC2=CC=CS2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CS2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC)C

InChI

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