3-(naphthalen-2-ylsulfonylamino)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(naphthalen-2-ylsulfonylamino)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(2-naphthylsulfonylamino)propanamide CAS Name: 3-(2-naphthalenylsulfonylamino)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(naphthalen-2-ylsulfonylamino)propanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(2-naphthylsulfonylamino)propionamide Formula: C22H20N4O3S3 MolecularWeight: 484.6142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20N4O3S3/c27-20(24-21-25-26-22(31-21)30-15-16-6-2-1-3-7-16)12-13-23-32(28,29)19-11-10-17-8-4-5-9-18(17)14-19/h1-11,14,23H,12-13,15H2,(H,24,25,27)