3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(4-ethylphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(4-ethylphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(4-ethylphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(4-ethylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(4-ethylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-1-(4-ethylphenyl)-1-(3-pyridylmethyl)thiourea Formula: C26H29N5S MolecularWeight: 443.60696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC2=CN=CC=C2)C(=S)NCCC3=NC4=C(N3)C=C(C(=C4)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC2=CN=CC=C2)C(=S)NCCC3=NC4=C(N3)C=C(C(=C4)C)C

InChI

InChI=1S/C26H29N5S/c1-4-20-7-9-22(10-8-20)31(17-21-6-5-12-27-16-21)26(32)28-13-11-25-29-23-14-18(2)19(3)15-24(23)30-25/h5-10,12,14-16H,4,11,13,17H2,1-3H3,(H,28,32)(H,29,30)