N-[4-(1H-benzimidazol-2-ylamino)-4-oxidanylidene-butyl]-5,6-dimethoxy-1H-indole-2-carboxamide

Systemtic Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxidanylidene-butyl]-5,6-dimethoxy-1H-indole-2-carboxamide Openeye Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxo-butyl]-5,6-dimethoxy-1H-indole-2-carboxamide CAS Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxobutyl]-5,6-dimethoxy-1H-indole-2-carboxamide IUPAC Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxobutyl]-5,6-dimethoxy-1H-indole-2-carboxamide Traditional Name: N-[4-(1H-benzimidazol-2-ylamino)-4-keto-butyl]-5,6-dimethoxy-1H-indole-2-carboxamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(N2)C(=O)NCCCC(=O)NC3=NC4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(N2)C(=O)NCCCC(=O)NC3=NC4=CC=CC=C4N3)OC

InChI

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