5-chloranyl-N-[2-(1-methylimidazol-4-yl)ethyl]-3-(phenylsulfonyl)-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(1-methylimidazol-4-yl)ethyl]-3-(phenylsulfonyl)-1H-indole-2-carboxamide Openeye Name: 3-(benzenesulfonyl)-5-chloro-N-[2-(1-methylimidazol-4-yl)ethyl]-1H-indole-2-carboxamide CAS Name: 3-(benzenesulfonyl)-5-chloro-N-[2-(1-methyl-4-imidazolyl)ethyl]-1H-indole-2-carboxamide IUPAC Name: 3-(benzenesulfonyl)-5-chloro-N-[2-(1-methylimidazol-4-yl)ethyl]-1H-indole-2-carboxamide Traditional Name: 3-besyl-5-chloro-N-[2-(1-methylimidazol-4-yl)ethyl]-1H-indole-2-carboxamide Formula: C21H19ClN4O3S MolecularWeight: 442.91856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CCNC(=O)C2=C(C3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(N=C1)CCNC(=O)C2=C(C3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19ClN4O3S/c1-26-12-15(24-13-26)9-10-23-21(27)19-20(17-11-14(22)7-8-18(17)25-19)30(28,29)16-5-3-2-4-6-16/h2-8,11-13,25H,9-10H2,1H3,(H,23,27)