3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Formula: C21H20N4O3S3 MolecularWeight: 472.6035

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

C=CCSC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O3S3/c1-2-13-29-21-24-23-20(30-21)22-19(26)16-8-5-10-17(14-16)31(27,28)25-12-6-9-15-7-3-4-11-18(15)25/h2-5,7-8,10-11,14H,1,6,9,12-13H2,(H,22,23,26)