N-(2-ethylhexyl)-2-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1-(thiophen-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: N-(2-ethylhexyl)-2-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1-(thiophen-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: N-(2-ethylhexyl)-2-methyl-5-(2-methylthiazol-4-yl)-1-(2-thienylmethyl)pyrrole-3-carboxamide CAS Name: N-(2-ethylhexyl)-2-methyl-5-(2-methyl-4-thiazolyl)-1-(thiophen-2-ylmethyl)-3-pyrrolecarboxamide IUPAC Name: N-(2-ethylhexyl)-2-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1-(thiophen-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: N-(2-ethylhexyl)-2-methyl-5-(2-methylthiazol-4-yl)-1-(2-thenyl)pyrrole-3-carboxamide Formula: C23H31N3OS2 MolecularWeight: 429.64174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C)CC3=CC=CS3)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C)CC3=CC=CS3)C

InChI

InChI=1S/C23H31N3OS2/c1-5-7-9-18(6-2)13-24-23(27)20-12-22(21-15-29-17(4)25-21)26(16(20)3)14-19-10-8-11-28-19/h8,10-12,15,18H,5-7,9,13-14H2,1-4H3,(H,24,27)