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

Systemtic Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-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)CCN(CC3=CN=CC=C3)C(=S)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)CCN(CC3=CN=CC=C3)C(=S)NC4=CC(=CC=C4)OC

InChI

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