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

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

CC1=C(C=C(N1CCC2=CCCCC2)C3=CSC(=N3)C4=CC=CC=C4)C(=O)NCC(C)C

Isomeric SMILES

CC1=C(C=C(N1CCC2=CCCCC2)C3=CSC(=N3)C4=CC=CC=C4)C(=O)NCC(C)C

InChI

InChI=1S/C27H33N3OS/c1-19(2)17-28-26(31)23-16-25(24-18-32-27(29-24)22-12-8-5-9-13-22)30(20(23)3)15-14-21-10-6-4-7-11-21/h5,8-10,12-13,16,18-19H,4,6-7,11,14-15,17H2,1-3H3,(H,28,31)