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

Systemtic Name: N-butyl-1-(cyclohexylmethyl)-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: N-butyl-1-(cyclohexylmethyl)-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: N-butyl-1-(cyclohexylmethyl)-2-methyl-5-(2-phenyl-4-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: N-butyl-1-(cyclohexylmethyl)-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: N-butyl-1-(cyclohexylmethyl)-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide Formula: C26H33N3OS MolecularWeight: 435.62472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CC4CCCCC4)C

Isomeric SMILES

CCCCNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CC4CCCCC4)C

InChI

InChI=1S/C26H33N3OS/c1-3-4-15-27-25(30)22-16-24(29(19(22)2)17-20-11-7-5-8-12-20)23-18-31-26(28-23)21-13-9-6-10-14-21/h6,9-10,13-14,16,18,20H,3-5,7-8,11-12,15,17H2,1-2H3,(H,27,30)