2-[3-(4-azanylbutyl)-2-(1,3-thiazol-2-yl)-1H-indol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-azanylbutyl)-2-(1,3-thiazol-2-yl)-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-aminobutyl)-2-thiazol-2-yl-1H-indol-5-yl]acetic acid CAS Name: 2-[3-(4-aminobutyl)-2-(2-thiazolyl)-1H-indol-5-yl]acetic acid IUPAC Name: 2-[3-(4-aminobutyl)-2-(1,3-thiazol-2-yl)-1H-indol-5-yl]acetic acid Traditional Name: 2-[3-(4-aminobutyl)-2-thiazol-2-yl-1H-indol-5-yl]acetic acid Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC(=O)O)C(=C(N2)C3=NC=CS3)CCCCN

Isomeric SMILES

C1=CC2=C(C=C1CC(=O)O)C(=C(N2)C3=NC=CS3)CCCCN

InChI

InChI=1S/C17H19N3O2S/c18-6-2-1-3-12-13-9-11(10-15(21)22)4-5-14(13)20-16(12)17-19-7-8-23-17/h4-5,7-9,20H,1-3,6,10,18H2,(H,21,22)