7-[1H-indol-5-yl(thiophen-2-ylsulfonyl)amino]heptanoic acid

Systemtic Name: 7-[1H-indol-5-yl(thiophen-2-ylsulfonyl)amino]heptanoic acid Openeye Name: 7-[1H-indol-5-yl(2-thienylsulfonyl)amino]heptanoic acid CAS Name: 7-[1H-indol-5-yl(thiophen-2-ylsulfonyl)amino]heptanoic acid IUPAC Name: 7-[1H-indol-5-yl(thiophen-2-ylsulfonyl)amino]heptanoic acid Traditional Name: 7-[1H-indol-5-yl(2-thienylsulfonyl)amino]enanthic acid Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)S(=O)(=O)N(CCCCCCC(=O)O)C2=CC3=C(C=C2)NC=C3

Isomeric SMILES

C1=CSC(=C1)S(=O)(=O)N(CCCCCCC(=O)O)C2=CC3=C(C=C2)NC=C3

InChI

InChI=1S/C19H22N2O4S2/c22-18(23)6-3-1-2-4-12-21(27(24,25)19-7-5-13-26-19)16-8-9-17-15(14-16)10-11-20-17/h5,7-11,13-14,20H,1-4,6,12H2,(H,22,23)