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

Systemtic Name: N,1-dibutyl-5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide Openeye Name: N,1-dibutyl-5-[2-(2-chlorophenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide CAS Name: N,1-dibutyl-5-[2-(2-chlorophenyl)-4-thiazolyl]-2-methyl-3-pyrrolecarboxamide IUPAC Name: N,1-dibutyl-5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxamide Traditional Name: N,1-dibutyl-5-[2-(2-chlorophenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide Formula: C23H28ClN3OS MolecularWeight: 430.00592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3Cl)CCCC)C

Isomeric SMILES

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3Cl)CCCC)C

InChI

InChI=1S/C23H28ClN3OS/c1-4-6-12-25-22(28)18-14-21(27(16(18)3)13-7-5-2)20-15-29-23(26-20)17-10-8-9-11-19(17)24/h8-11,14-15H,4-7,12-13H2,1-3H3,(H,25,28)