4-piperidin-1-ylsulfonyl-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-piperidin-1-ylsulfonyl-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-(5-isopropylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(1-piperidylsulfonyl)benzamide CAS Name: 4-(1-piperidinylsulfonyl)-N-[5-(propan-2-ylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-piperidin-1-ylsulfonyl-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-[5-(isopropylthio)-1,3,4-thiadiazol-2-yl]-4-piperidinosulfonyl-benzamide Formula: C17H22N4O3S3 MolecularWeight: 426.57658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)SC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H22N4O3S3/c1-12(2)25-17-20-19-16(26-17)18-15(22)13-6-8-14(9-7-13)27(23,24)21-10-4-3-5-11-21/h6-9,12H,3-5,10-11H2,1-2H3,(H,18,19,22)