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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=C(C=C2C3=CSC(=N3)CC#N)C(=O)N)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=C(C=C2C3=CSC(=N3)CC#N)C(=O)N)C

InChI

InChI=1S/C19H18N4OS/c1-12-4-3-5-14(8-12)10-23-13(2)15(19(21)24)9-17(23)16-11-25-18(22-16)6-7-20/h3-5,8-9,11H,6,10H2,1-2H3,(H2,21,24)