N-(4-methoxyphenyl)-5-[[2-oxidanylidene-2-(3-piperidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-5-[[2-oxidanylidene-2-(3-piperidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-methoxyphenyl)-5-[[2-oxo-2-[3-(1-piperidyl)propylamino]ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methoxyphenyl)-5-[[[2-oxo-2-[3-(1-piperidinyl)propylamino]ethyl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methoxyphenyl)-5-[[2-oxo-2-(3-piperidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[[2-keto-2-(3-piperidinopropylamino)ethyl]thio]methyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C21H29N5O3S2 MolecularWeight: 463.61666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NCCCN3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NCCCN3CCCCC3

InChI

InChI=1S/C21H29N5O3S2/c1-29-17-8-6-16(7-9-17)23-20(28)21-25-24-19(31-21)15-30-14-18(27)22-10-5-13-26-11-3-2-4-12-26/h6-9H,2-5,10-15H2,1H3,(H,22,27)(H,23,28)