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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-3-ylcarbonylamino)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indole-3-carbonylamino)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[1H-indol-3-yl(oxo)methyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indole-3-carbonylamino)thiourea Traditional Name: 1-homoveratryl-3-(1H-indole-3-carbonylamino)thiourea Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C2=CNC3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C2=CNC3=CC=CC=C32)OC

InChI

InChI=1S/C20H22N4O3S/c1-26-17-8-7-13(11-18(17)27-2)9-10-21-20(28)24-23-19(25)15-12-22-16-6-4-3-5-14(15)16/h3-8,11-12,22H,9-10H2,1-2H3,(H,23,25)(H2,21,24,28)