5-[2-(cyanomethyl)-1,3-thiazol-4-yl]-2-methyl-1-phenethyl-pyrrole-3-carboxamide

Systemtic Name: 5-[2-(cyanomethyl)-1,3-thiazol-4-yl]-2-methyl-1-phenethyl-pyrrole-3-carboxamide Openeye Name: 5-[2-(cyanomethyl)thiazol-4-yl]-2-methyl-1-phenethyl-pyrrole-3-carboxamide CAS Name: 5-[2-(cyanomethyl)-4-thiazolyl]-2-methyl-1-phenethyl-3-pyrrolecarboxamide IUPAC Name: 5-[2-(cyanomethyl)-1,3-thiazol-4-yl]-2-methyl-1-phenethylpyrrole-3-carboxamide Traditional Name: 5-[2-(cyanomethyl)thiazol-4-yl]-2-methyl-1-phenethyl-pyrrole-3-carboxamide Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCC2=CC=CC=C2)C3=CSC(=N3)CC#N)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CCC2=CC=CC=C2)C3=CSC(=N3)CC#N)C(=O)N

InChI

InChI=1S/C19H18N4OS/c1-13-15(19(21)24)11-17(16-12-25-18(22-16)7-9-20)23(13)10-8-14-5-3-2-4-6-14/h2-6,11-12H,7-8,10H2,1H3,(H2,21,24)