N-butyl-1-[2-(cyclohexen-1-yl)ethyl]-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide

Systemtic Name: N-butyl-1-[2-(cyclohexen-1-yl)ethyl]-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: N-butyl-1-[2-(cyclohexen-1-yl)ethyl]-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: N-butyl-1-[2-(1-cyclohexenyl)ethyl]-2-methyl-5-(2-phenyl-4-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: N-butyl-1-[2-(cyclohexen-1-yl)ethyl]-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: N-butyl-1-[2-(cyclohexen-1-yl)ethyl]-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide Formula: C27H33N3OS MolecularWeight: 447.63542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CCC4=CCCCC4)C

Isomeric SMILES

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CCC4=CCCCC4)C

InChI

InChI=1S/C27H33N3OS/c1-3-4-16-28-26(31)23-18-25(24-19-32-27(29-24)22-13-9-6-10-14-22)30(20(23)2)17-15-21-11-7-5-8-12-21/h6,9-11,13-14,18-19H,3-5,7-8,12,15-17H2,1-2H3,(H,28,31)