(4E)-N-(1,3-benzothiazol-2-yl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide

Systemtic Name: (4E)-N-(1,3-benzothiazol-2-yl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-N-(1,3-benzothiazol-2-yl)-4-(carbamothioylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-N-(1,3-benzothiazol-2-yl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N-(1,3-benzothiazol-2-yl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-N-(1,3-benzothiazol-2-yl)-3-methyl-4-(thiocarbamoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C18H17N5O2S2 MolecularWeight: 399.48988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)N)CCC2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)N)/CCC2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H17N5O2S2/c1-9-14-11(22-23-17(19)26)6-4-7-12(14)25-15(9)16(24)21-18-20-10-5-2-3-8-13(10)27-18/h2-3,5,8H,4,6-7H2,1H3,(H3,19,23,26)(H,20,21,24)/b22-11+