2-methyl-1-(2-methylpropyl)-5-(2-phenyl-1,3-thiazol-4-yl)-N-prop-2-enyl-pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(2-methylpropyl)-5-(2-phenyl-1,3-thiazol-4-yl)-N-prop-2-enyl-pyrrole-3-carboxamide Openeye Name: N-allyl-1-isobutyl-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-(2-methylpropyl)-5-(2-phenyl-4-thiazolyl)-N-prop-2-enyl-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(2-methylpropyl)-5-(2-phenyl-1,3-thiazol-4-yl)-N-prop-2-enylpyrrole-3-carboxamide Traditional Name: N-allyl-1-isobutyl-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC(C)C)C2=CSC(=N2)C3=CC=CC=C3)C(=O)NCC=C

Isomeric SMILES

CC1=C(C=C(N1CC(C)C)C2=CSC(=N2)C3=CC=CC=C3)C(=O)NCC=C

InChI

InChI=1S/C22H25N3OS/c1-5-11-23-21(26)18-12-20(25(16(18)4)13-15(2)3)19-14-27-22(24-19)17-9-7-6-8-10-17/h5-10,12,14-15H,1,11,13H2,2-4H3,(H,23,26)