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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=N3

InChI

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