1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-3-ylcarbonylamino)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-3-ylcarbonylamino)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridine-3-carbonylamino)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[oxo(3-pyridinyl)methyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridine-3-carbonylamino)thiourea Traditional Name: 1-homoveratryl-3-nicotinamido-thiourea Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C2=CN=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C2=CN=CC=C2)OC

InChI

InChI=1S/C17H20N4O3S/c1-23-14-6-5-12(10-15(14)24-2)7-9-19-17(25)21-20-16(22)13-4-3-8-18-11-13/h3-6,8,10-11H,7,9H2,1-2H3,(H,20,22)(H2,19,21,25)