N-[(4-methylphenyl)methyl]-5-(piperidin-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-5-(piperidin-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-(1-piperidylmethyl)-N-(p-tolylmethyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-5-(1-piperidinylmethyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-5-(piperidin-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-methylbenzyl)-5-(piperidinomethyl)-1,3,4-thiadiazole-2-carboxamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CN3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CN3CCCCC3

InChI

InChI=1S/C17H22N4OS/c1-13-5-7-14(8-6-13)11-18-16(22)17-20-19-15(23-17)12-21-9-3-2-4-10-21/h5-8H,2-4,9-12H2,1H3,(H,18,22)