4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C22H27N5O4S MolecularWeight: 457.54588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CN3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CN3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C22H27N5O4S/c1-3-15-5-4-6-17-18(12-24-21(15)17)20(28)14-26-7-9-27(10-8-26)32(30,31)16-11-19(22(23)29)25(2)13-16/h4-6,11-13,24H,3,7-10,14H2,1-2H3,(H2,23,29)