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

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

CCCCN1C(=C(C=C1C2=CSC(=N2)C3=CC=CC=C3)C(=O)NCC=C)C

Isomeric SMILES

CCCCN1C(=C(C=C1C2=CSC(=N2)C3=CC=CC=C3)C(=O)NCC=C)C

InChI

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