5-butyl-2-methyl-1-(3-oxidanylpropyl)-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-1-(3-oxidanylpropyl)-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Openeye Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-thiazol-2-yl-pyrrole-3-carboxamide CAS Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-(2-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Traditional Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-thiazol-2-yl-pyrrole-3-carboxamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCCO)C)C(=O)N)C2=NC=CS2

Isomeric SMILES

CCCCC1=C(C(=C(N1CCCO)C)C(=O)N)C2=NC=CS2

InChI

InChI=1S/C16H23N3O2S/c1-3-4-6-12-14(16-18-7-10-22-16)13(15(17)21)11(2)19(12)8-5-9-20/h7,10,20H,3-6,8-9H2,1-2H3,(H2,17,21)