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

Systemtic Name: 5-butyl-2-methyl-1-(3-morpholin-4-ylpropyl)-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Openeye Name: 5-butyl-2-methyl-1-(3-morpholinopropyl)-4-thiazol-2-yl-pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-1-[3-(4-morpholinyl)propyl]-4-(2-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-1-(3-morpholin-4-ylpropyl)-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-1-(3-morpholinopropyl)-4-thiazol-2-yl-pyrrole-3-carboxamide Formula: C20H30N4O2S MolecularWeight: 390.5428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCCN2CCOCC2)C)C(=O)N)C3=NC=CS3

Isomeric SMILES

CCCCC1=C(C(=C(N1CCCN2CCOCC2)C)C(=O)N)C3=NC=CS3

InChI

InChI=1S/C20H30N4O2S/c1-3-4-6-16-18(20-22-7-14-27-20)17(19(21)25)15(2)24(16)9-5-8-23-10-12-26-13-11-23/h7,14H,3-6,8-13H2,1-2H3,(H2,21,25)