4-methoxy-N,1-dimethyl-5-[1-methyl-5-(3-methylbutanoylamino)benzimidazol-2-yl]pyrrole-3-carboxamide

Systemtic Name: 4-methoxy-N,1-dimethyl-5-[1-methyl-5-(3-methylbutanoylamino)benzimidazol-2-yl]pyrrole-3-carboxamide Openeye Name: 4-methoxy-N,1-dimethyl-5-[1-methyl-5-(3-methylbutanoylamino)benzimidazol-2-yl]pyrrole-3-carboxamide CAS Name: 4-methoxy-N,1-dimethyl-5-[1-methyl-5-[(3-methyl-1-oxobutyl)amino]-2-benzimidazolyl]-3-pyrrolecarboxamide IUPAC Name: 4-methoxy-N,1-dimethyl-5-[1-methyl-5-(3-methylbutanoylamino)benzimidazol-2-yl]pyrrole-3-carboxamide Traditional Name: 5-[5-(isovalerylamino)-1-methyl-benzimidazol-2-yl]-4-methoxy-N,1-dimethyl-pyrrole-3-carboxamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC2=C(C=C1)N(C(=N2)C3=C(C(=CN3C)C(=O)NC)OC)C

Isomeric SMILES

CC(C)CC(=O)NC1=CC2=C(C=C1)N(C(=N2)C3=C(C(=CN3C)C(=O)NC)OC)C

InChI

InChI=1S/C21H27N5O3/c1-12(2)9-17(27)23-13-7-8-16-15(10-13)24-20(26(16)5)18-19(29-6)14(11-25(18)4)21(28)22-3/h7-8,10-12H,9H2,1-6H3,(H,22,28)(H,23,27)