N-[3-[2-[2-(1,3-benzothiazol-2-ylamino)ethanoyl]hydrazinyl]-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[2-[2-(1,3-benzothiazol-2-ylamino)ethanoyl]hydrazinyl]-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-[2-[2-(1,3-benzothiazol-2-ylamino)acetyl]hydrazino]-3-oxo-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]hydrazo]-3-oxopropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-[2-[2-(1,3-benzothiazol-2-ylamino)acetyl]hydrazinyl]-3-oxopropyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[N'-[2-(1,3-benzothiazol-2-ylamino)acetyl]hydrazino]-3-keto-propyl]-4-methyl-benzenesulfonamide Formula: C19H21N5O4S2 MolecularWeight: 447.53114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NNC(=O)CNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NNC(=O)CNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H21N5O4S2/c1-13-6-8-14(9-7-13)30(27,28)21-11-10-17(25)23-24-18(26)12-20-19-22-15-4-2-3-5-16(15)29-19/h2-9,21H,10-12H2,1H3,(H,20,22)(H,23,25)(H,24,26)