3-[(6-chloranyl-2-oxidanylidene-3H-indol-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 3-[(6-chloranyl-2-oxidanylidene-3H-indol-1-yl)methyl]benzenecarbothioamide Openeye Name: 3-[(6-chloro-2-oxo-indolin-1-yl)methyl]benzenecarbothioamide CAS Name: 3-[(6-chloro-2-oxo-3H-indol-1-yl)methyl]benzenecarbothioamide IUPAC Name: 3-[(6-chloro-2-oxo-3H-indol-1-yl)methyl]benzenecarbothioamide Traditional Name: 3-[(6-chloro-2-keto-indolin-1-yl)methyl]thiobenzamide Formula: C16H13ClN2OS MolecularWeight: 316.80522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)Cl)N(C1=O)CC3=CC=CC(=C3)C(=S)N

Isomeric SMILES

C1C2=C(C=C(C=C2)Cl)N(C1=O)CC3=CC=CC(=C3)C(=S)N

InChI

InChI=1S/C16H13ClN2OS/c17-13-5-4-11-7-15(20)19(14(11)8-13)9-10-2-1-3-12(6-10)16(18)21/h1-6,8H,7,9H2,(H2,18,21)