3-(4-azanylbutyl)-2-(4-methylthiophen-2-yl)-1H-indole-5-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-2-(4-methylthiophen-2-yl)-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(4-methyl-2-thienyl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(4-methyl-2-thiophenyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(4-methylthiophen-2-yl)-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(4-methyl-2-thienyl)-1H-indole-5-carboxylic acid Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN

Isomeric SMILES

CC1=CSC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN

InChI

InChI=1S/C18H20N2O2S/c1-11-8-16(23-10-11)17-13(4-2-3-7-19)14-9-12(18(21)22)5-6-15(14)20-17/h5-6,8-10,20H,2-4,7,19H2,1H3,(H,21,22)