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

Systemtic Name: N-(2-ethylhexyl)-1-(3-methoxypropyl)-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: N-(2-ethylhexyl)-1-(3-methoxypropyl)-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: N-(2-ethylhexyl)-1-(3-methoxypropyl)-2-methyl-5-(2-phenyl-4-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: N-(2-ethylhexyl)-1-(3-methoxypropyl)-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: N-(2-ethylhexyl)-1-(3-methoxypropyl)-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide Formula: C27H37N3O2S MolecularWeight: 467.66658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CCCOC)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CCCOC)C

InChI

InChI=1S/C27H37N3O2S/c1-5-7-12-21(6-2)18-28-26(31)23-17-25(30(20(23)3)15-11-16-32-4)24-19-33-27(29-24)22-13-9-8-10-14-22/h8-10,13-14,17,19,21H,5-7,11-12,15-16,18H2,1-4H3,(H,28,31)