1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-1-homoveratryl-3-(3-methoxyphenyl)thiourea Formula: C30H33N3O4S MolecularWeight: 531.66572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC3=CC(=C(C=C3)OC)OC)C(=S)NC4=CC(=CC=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC3=CC(=C(C=C3)OC)OC)C(=S)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C30H33N3O4S/c1-5-20-9-11-26-22(15-20)17-23(29(34)32-26)19-33(30(38)31-24-7-6-8-25(18-24)35-2)14-13-21-10-12-27(36-3)28(16-21)37-4/h6-12,15-18H,5,13-14,19H2,1-4H3,(H,31,38)(H,32,34)