1-[(2-chlorophenyl)methyl]-3-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(4-ethoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(2-chlorophenyl)methyl]-3-(4-ethoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-p-phenetyl-1-(3-pyridylmethyl)thiourea Formula: C22H22ClN3OS MolecularWeight: 411.94758

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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=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C22H22ClN3OS/c1-2-27-20-11-9-19(10-12-20)25-22(28)26(15-17-6-5-13-24-14-17)16-18-7-3-4-8-21(18)23/h3-14H,2,15-16H2,1H3,(H,25,28)