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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea Traditional Name: 1-homoveratryl-3-[2-(2-keto-7-methoxy-1H-quinolin-3-yl)ethyl]thiourea Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H27N3O4S/c1-28-18-6-5-16-13-17(22(27)26-19(16)14-18)9-11-25-23(31)24-10-8-15-4-7-20(29-2)21(12-15)30-3/h4-7,12-14H,8-11H2,1-3H3,(H,26,27)(H2,24,25,31)