5-bromanyl-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1H-indole-2-carboxamide Openeye Name: 5-bromo-N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-1H-indole-2-carboxamide CAS Name: 5-bromo-N-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-1H-indole-2-carboxamide IUPAC Name: 5-bromo-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1H-indole-2-carboxamide Traditional Name: 5-bromo-N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-1H-indole-2-carboxamide Formula: C21H22BrN3O4S MolecularWeight: 492.38608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C21H22BrN3O4S/c1-29-17-3-5-18(6-4-17)30(27,28)25-10-8-16(9-11-25)23-21(26)20-13-14-12-15(22)2-7-19(14)24-20/h2-7,12-13,16,24H,8-11H2,1H3,(H,23,26)