2-methyl-1-(phenylmethyl)-5-(2-pyridin-3-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(phenylmethyl)-5-(2-pyridin-3-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-2-methyl-5-[2-(3-pyridyl)thiazol-4-yl]pyrrole-3-carboxamide CAS Name: 2-methyl-1-(phenylmethyl)-5-[2-(3-pyridinyl)-4-thiazolyl]-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-2-methyl-5-(2-pyridin-3-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: 1-benzyl-2-methyl-5-[2-(3-pyridyl)thiazol-4-yl]pyrrole-3-carboxamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC=CC=C2)C3=CSC(=N3)C4=CN=CC=C4)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CC2=CC=CC=C2)C3=CSC(=N3)C4=CN=CC=C4)C(=O)N

InChI

InChI=1S/C21H18N4OS/c1-14-17(20(22)26)10-19(25(14)12-15-6-3-2-4-7-15)18-13-27-21(24-18)16-8-5-9-23-11-16/h2-11,13H,12H2,1H3,(H2,22,26)