N-[4-(1H-benzimidazol-2-ylamino)-4-oxidanylidene-butyl]-4,7-dimethoxy-1H-indole-2-carboxamide

Systemtic Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxidanylidene-butyl]-4,7-dimethoxy-1H-indole-2-carboxamide Openeye Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxo-butyl]-4,7-dimethoxy-1H-indole-2-carboxamide CAS Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxobutyl]-4,7-dimethoxy-1H-indole-2-carboxamide IUPAC Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxobutyl]-4,7-dimethoxy-1H-indole-2-carboxamide Traditional Name: N-[4-(1H-benzimidazol-2-ylamino)-4-keto-butyl]-4,7-dimethoxy-1H-indole-2-carboxamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NCCCC(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NCCCC(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H23N5O4/c1-30-17-9-10-18(31-2)20-13(17)12-16(24-20)21(29)23-11-5-8-19(28)27-22-25-14-6-3-4-7-15(14)26-22/h3-4,6-7,9-10,12,24H,5,8,11H2,1-2H3,(H,23,29)(H2,25,26,27,28)