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

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(4-phenoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(4-phenoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(2-chlorophenyl)methyl]-3-(4-phenoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(4-phenoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-(4-phenoxyphenyl)-1-(3-pyridylmethyl)thiourea Formula: C26H22ClN3OS MolecularWeight: 459.99038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)N(CC3=CN=CC=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)N(CC3=CN=CC=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C26H22ClN3OS/c27-25-11-5-4-8-21(25)19-30(18-20-7-6-16-28-17-20)26(32)29-22-12-14-24(15-13-22)31-23-9-2-1-3-10-23/h1-17H,18-19H2,(H,29,32)