1-(2-cyanoethyl)-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NCCC#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NCCC#N

InChI

InChI=1S/C13H17N3O3S/c1-17-10-7-9(8-11(18-2)12(10)19-3)16-13(20)15-6-4-5-14/h7-8H,4,6H2,1-3H3,(H2,15,16,20)