N-[5-methyl-3-(4-piperidin-1-ylbut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide

Systemtic Name: N-[5-methyl-3-(4-piperidin-1-ylbut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide Openeye Name: N-[5-methyl-3-[4-(1-piperidyl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide CAS Name: N-[5-methyl-3-[4-(1-piperidinyl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide IUPAC Name: N-[5-methyl-3-(4-piperidin-1-ylbut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide Traditional Name: N-[5-methyl-3-(4-piperidinobut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=NC(=O)C2=CC=CC=C2)S1)CC#CCN3CCCCC3

Isomeric SMILES

CC1=NN(C(=NC(=O)C2=CC=CC=C2)S1)CC#CCN3CCCCC3

InChI

InChI=1S/C19H22N4OS/c1-16-21-23(15-9-8-14-22-12-6-3-7-13-22)19(25-16)20-18(24)17-10-4-2-5-11-17/h2,4-5,10-11H,3,6-7,12-15H2,1H3