N-[(2S)-butan-2-yl]-6-(cyclohexylcarbonylamino)-3-(2-methoxyethyl)benzimidazole-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-6-(cyclohexylcarbonylamino)-3-(2-methoxyethyl)benzimidazole-4-carboxamide Openeye Name: 6-(cyclohexanecarbonylamino)-3-(2-methoxyethyl)-N-[(1S)-1-methylpropyl]benzimidazole-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-6-[[cyclohexyl(oxo)methyl]amino]-3-(2-methoxyethyl)-4-benzimidazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-6-(cyclohexanecarbonylamino)-3-(2-methoxyethyl)benzimidazole-4-carboxamide Traditional Name: 6-(cyclohexanecarbonylamino)-3-(2-methoxyethyl)-N-[(1S)-1-methylpropyl]benzimidazole-4-carboxamide Formula: C22H32N4O3 MolecularWeight: 400.51448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC2=C1N(C=N2)CCOC)NC(=O)C3CCCCC3

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=CC2=C1N(C=N2)CCOC)NC(=O)C3CCCCC3

InChI

InChI=1S/C22H32N4O3/c1-4-15(2)24-22(28)18-12-17(25-21(27)16-8-6-5-7-9-16)13-19-20(18)26(14-23-19)10-11-29-3/h12-16H,4-11H2,1-3H3,(H,24,28)(H,25,27)/t15-/m0/s1