3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(2-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(2-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(2-methoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(2-methoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(2-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(2-methoxyphenyl)-1-(3-pyridylmethyl)thiourea Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)CCNC(=S)N(CC3=CN=CC=C3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)CCNC(=S)N(CC3=CN=CC=C3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H27N5OS/c1-17-13-20-21(14-18(17)2)29-24(28-20)10-12-27-25(32)30(16-19-7-6-11-26-15-19)22-8-4-5-9-23(22)31-3/h4-9,11,13-15H,10,12,16H2,1-3H3,(H,27,32)(H,28,29)