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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-methyl-thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methyl-thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methylthiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methylthiourea Traditional Name: 1-homoveratryl-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-methyl-thiourea Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCC3=CC(=C(C=C3)OC)OC)C(=S)NC)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCC3=CC(=C(C=C3)OC)OC)C(=S)NC)C

InChI

InChI=1S/C24H29N3O3S/c1-15-10-16(2)19-13-18(23(28)26-20(19)11-15)14-27(24(31)25-3)9-8-17-6-7-21(29-4)22(12-17)30-5/h6-7,10-13H,8-9,14H2,1-5H3,(H,25,31)(H,26,28)