(3-chloranyl-6-methyl-1-benzothiophen-2-yl)carbonyl-(1,3-dihydrobenzimidazol-2-ylidene)azanium

Systemtic Name: (3-chloranyl-6-methyl-1-benzothiophen-2-yl)carbonyl-(1,3-dihydrobenzimidazol-2-ylidene)azanium Openeye Name: (3-chloro-6-methyl-benzothiophene-2-carbonyl)-(1,3-dihydrobenzimidazol-2-ylidene)ammonium CAS Name: [(3-chloro-6-methyl-1-benzothiophen-2-yl)-oxomethyl]-(1,3-dihydrobenzimidazol-2-ylidene)ammonium IUPAC Name: (3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-(1,3-dihydrobenzimidazol-2-ylidene)azanium Traditional Name: (3-chloro-6-methyl-benzothiophene-2-carbonyl)-(1,3-dihydrobenzimidazol-2-ylidene)ammonium Formula: C17H13ClN3OS+ MolecularWeight: 342.82262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)[NH+]=C3NC4=CC=CC=C4N3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)[NH+]=C3NC4=CC=CC=C4N3)Cl

InChI

InChI=1S/C17H12ClN3OS/c1-9-6-7-10-13(8-9)23-15(14(10)18)16(22)21-17-19-11-4-2-3-5-12(11)20-17/h2-8H,1H3,(H2,19,20,21,22)/p+1