2-methyl-1-(oxolan-2-ylmethyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxylic acid

Systemtic Name: 2-methyl-1-(oxolan-2-ylmethyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxylic acid Openeye Name: 2-methyl-5-(2-pyrazin-2-ylthiazol-4-yl)-1-(tetrahydrofuran-2-ylmethyl)pyrrole-3-carboxylic acid CAS Name: 2-methyl-1-(2-oxolanylmethyl)-5-[2-(2-pyrazinyl)-4-thiazolyl]-3-pyrrolecarboxylic acid IUPAC Name: 2-methyl-1-(oxolan-2-ylmethyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxylic acid Traditional Name: 2-methyl-5-(2-pyrazin-2-ylthiazol-4-yl)-1-(tetrahydrofurfuryl)pyrrole-3-carboxylic acid Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2CCCO2)C3=CSC(=N3)C4=NC=CN=C4)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC2CCCO2)C3=CSC(=N3)C4=NC=CN=C4)C(=O)O

InChI

InChI=1S/C18H18N4O3S/c1-11-13(18(23)24)7-16(22(11)9-12-3-2-6-25-12)15-10-26-17(21-15)14-8-19-4-5-20-14/h4-5,7-8,10,12H,2-3,6,9H2,1H3,(H,23,24)