N-[5-methyl-3-[4-(3-methylpiperidin-1-yl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide

Systemtic Name: N-[5-methyl-3-[4-(3-methylpiperidin-1-yl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide Openeye Name: N-[5-methyl-3-[4-(3-methyl-1-piperidyl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide CAS Name: N-[5-methyl-3-[4-(3-methyl-1-piperidinyl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide IUPAC Name: N-[5-methyl-3-[4-(3-methylpiperidin-1-yl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide Traditional Name: N-[5-methyl-3-[4-(3-methylpiperidino)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC#CCN2C(=NC(=O)C3=CC=CC=C3)SC(=N2)C

Isomeric SMILES

CC1CCCN(C1)CC#CCN2C(=NC(=O)C3=CC=CC=C3)SC(=N2)C

InChI

InChI=1S/C20H24N4OS/c1-16-9-8-13-23(15-16)12-6-7-14-24-20(26-17(2)22-24)21-19(25)18-10-4-3-5-11-18/h3-5,10-11,16H,8-9,12-15H2,1-2H3