3-cyclopentyl-1-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]indole-6-carboxylic acid

Systemtic Name: 3-cyclopentyl-1-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]indole-6-carboxylic acid Openeye Name: 3-cyclopentyl-1-methyl-2-[2-(methylamino)thiazol-4-yl]indole-6-carboxylic acid CAS Name: 3-cyclopentyl-1-methyl-2-[2-(methylamino)-4-thiazolyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclopentyl-1-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]indole-6-carboxylic acid Traditional Name: 3-cyclopentyl-1-methyl-2-[2-(methylamino)thiazol-4-yl]indole-6-carboxylic acid Formula: C19H21N3O2S MolecularWeight: 355.45394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=CS1)C2=C(C3=C(N2C)C=C(C=C3)C(=O)O)C4CCCC4

Isomeric SMILES

CNC1=NC(=CS1)C2=C(C3=C(N2C)C=C(C=C3)C(=O)O)C4CCCC4

InChI

InChI=1S/C19H21N3O2S/c1-20-19-21-14(10-25-19)17-16(11-5-3-4-6-11)13-8-7-12(18(23)24)9-15(13)22(17)2/h7-11H,3-6H2,1-2H3,(H,20,21)(H,23,24)