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

Systemtic Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 1-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(3-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 1-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]-N-(3-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=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCCC3C(=O)NCC4=CN=CC=C4

InChI

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