1-(pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-(pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-(3-pyridylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-(3-pyridinylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-(pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-(3-pyridylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CN=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C16H19N3O3S/c1-20-13-7-12(8-14(21-2)15(13)22-3)19-16(23)18-10-11-5-4-6-17-9-11/h4-9H,10H2,1-3H3,(H2,18,19,23)