1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 1-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]-N-(2-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(2-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 1-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]-N-(2-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCCC3C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCCC3C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C21H23N5OS/c1-15-7-9-16(10-8-15)13-19-24-21(28-25-19)26-12-4-6-18(26)20(27)23-14-17-5-2-3-11-22-17/h2-3,5,7-11,18H,4,6,12-14H2,1H3,(H,23,27)