N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-6-(2-sulfanylethanoylamino)hexanamide

Systemtic Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-6-(2-sulfanylethanoylamino)hexanamide Openeye Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-6-[(2-sulfanylacetyl)amino]hexanamide CAS Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-6-[(2-mercapto-1-oxoethyl)amino]hexanamide IUPAC Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-6-[(2-sulfanylacetyl)amino]hexanamide Traditional Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-6-[(2-mercaptoacetyl)amino]hexanamide Formula: C16H19ClN4O2S2 MolecularWeight: 398.93066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(S2)NC(=O)CCCCCNC(=O)CS)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(S2)NC(=O)CCCCCNC(=O)CS)Cl

InChI

InChI=1S/C16H19ClN4O2S2/c17-12-7-5-11(6-8-12)15-20-21-16(25-15)19-13(22)4-2-1-3-9-18-14(23)10-24/h5-8,24H,1-4,9-10H2,(H,18,23)(H,19,21,22)