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

Systemtic Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxidanylidene-butyl]-4-methoxy-1H-indole-2-carboxamide Openeye Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxo-butyl]-4-methoxy-1H-indole-2-carboxamide CAS Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxobutyl]-4-methoxy-1H-indole-2-carboxamide IUPAC Name: N-[4-(1H-benzimidazol-2-ylamino)-4-oxobutyl]-4-methoxy-1H-indole-2-carboxamide Traditional Name: N-[4-(1H-benzimidazol-2-ylamino)-4-keto-butyl]-4-methoxy-1H-indole-2-carboxamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=C(N2)C(=O)NCCCC(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=CC2=C1C=C(N2)C(=O)NCCCC(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O3/c1-29-18-9-4-8-14-13(18)12-17(23-14)20(28)22-11-5-10-19(27)26-21-24-15-6-2-3-7-16(15)25-21/h2-4,6-9,12,23H,5,10-11H2,1H3,(H,22,28)(H2,24,25,26,27)