6-acetamido-3-(2-methoxyethyl)-N-(3-methylsulfanylpropyl)-2-pyridin-2-yl-benzimidazole-4-carboxamide

Systemtic Name: 6-acetamido-3-(2-methoxyethyl)-N-(3-methylsulfanylpropyl)-2-pyridin-2-yl-benzimidazole-4-carboxamide Openeye Name: 6-acetamido-3-(2-methoxyethyl)-N-(3-methylsulfanylpropyl)-2-(2-pyridyl)benzimidazole-4-carboxamide CAS Name: 6-acetamido-3-(2-methoxyethyl)-N-[3-(methylthio)propyl]-2-(2-pyridinyl)-4-benzimidazolecarboxamide IUPAC Name: 6-acetamido-3-(2-methoxyethyl)-N-(3-methylsulfanylpropyl)-2-pyridin-2-ylbenzimidazole-4-carboxamide Traditional Name: 6-acetamido-3-(2-methoxyethyl)-N-[3-(methylthio)propyl]-2-(2-pyridyl)benzimidazole-4-carboxamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C(=C1)C(=O)NCCCSC)N(C(=N2)C3=CC=CC=N3)CCOC

Isomeric SMILES

CC(=O)NC1=CC2=C(C(=C1)C(=O)NCCCSC)N(C(=N2)C3=CC=CC=N3)CCOC

InChI

InChI=1S/C22H27N5O3S/c1-15(28)25-16-13-17(22(29)24-9-6-12-31-3)20-19(14-16)26-21(27(20)10-11-30-2)18-7-4-5-8-23-18/h4-5,7-8,13-14H,6,9-12H2,1-3H3,(H,24,29)(H,25,28)