N,1-dibutyl-5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide

Systemtic Name: N,1-dibutyl-5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide Openeye Name: N,1-dibutyl-5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide CAS Name: N,1-dibutyl-5-[2-(4-methoxyphenyl)-4-thiazolyl]-2-methyl-3-pyrrolecarboxamide IUPAC Name: N,1-dibutyl-5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxamide Traditional Name: N,1-dibutyl-5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=C(C=C3)OC)CCCC)C

Isomeric SMILES

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=C(C=C3)OC)CCCC)C

InChI

InChI=1S/C24H31N3O2S/c1-5-7-13-25-23(28)20-15-22(27(17(20)3)14-8-6-2)21-16-30-24(26-21)18-9-11-19(29-4)12-10-18/h9-12,15-16H,5-8,13-14H2,1-4H3,(H,25,28)