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

Systemtic Name: 5-[2-(cyanomethyl)-1,3-thiazol-4-yl]-1-[(2-methoxyphenyl)methyl]-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-[2-(cyanomethyl)thiazol-4-yl]-1-[(2-methoxyphenyl)methyl]-2-methyl-pyrrole-3-carboxamide CAS Name: 5-[2-(cyanomethyl)-4-thiazolyl]-1-[(2-methoxyphenyl)methyl]-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-[2-(cyanomethyl)-1,3-thiazol-4-yl]-1-[(2-methoxyphenyl)methyl]-2-methylpyrrole-3-carboxamide Traditional Name: 5-[2-(cyanomethyl)thiazol-4-yl]-2-methyl-1-o-anisyl-pyrrole-3-carboxamide Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC=CC=C2OC)C3=CSC(=N3)CC#N)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CC2=CC=CC=C2OC)C3=CSC(=N3)CC#N)C(=O)N

InChI

InChI=1S/C19H18N4O2S/c1-12-14(19(21)24)9-16(15-11-26-18(22-15)7-8-20)23(12)10-13-5-3-4-6-17(13)25-2/h3-6,9,11H,7,10H2,1-2H3,(H2,21,24)