3-(2-ethoxyphenyl)-1-(pyridin-3-ylmethyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(2-ethoxyphenyl)-1-(pyridin-3-ylmethyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(2-ethoxyphenyl)-1-(3-pyridylmethyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-(2-ethoxyphenyl)-1-(3-pyridinylmethyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(2-ethoxyphenyl)-1-(pyridin-3-ylmethyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-o-phenetyl-1-(3-pyridylmethyl)-1-(4-pyridylmethyl)thiourea Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N(CC2=CC=NC=C2)CC3=CN=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N(CC2=CC=NC=C2)CC3=CN=CC=C3

InChI

InChI=1S/C21H22N4OS/c1-2-26-20-8-4-3-7-19(20)24-21(27)25(15-17-9-12-22-13-10-17)16-18-6-5-11-23-14-18/h3-14H,2,15-16H2,1H3,(H,24,27)