1-chloranyl-N-(3,4-dimethylphenyl)benzo[e][1]benzothiole-2-carboxamide

Systemtic Name: 1-chloranyl-N-(3,4-dimethylphenyl)benzo[e][1]benzothiole-2-carboxamide Openeye Name: 1-chloro-N-(3,4-dimethylphenyl)benzo[e]benzothiophene-2-carboxamide CAS Name: 1-chloro-N-(3,4-dimethylphenyl)-2-benzo[e][1]benzothiolecarboxamide IUPAC Name: 1-chloro-N-(3,4-dimethylphenyl)benzo[e][1]benzothiole-2-carboxamide Traditional Name: 1-chloro-N-(3,4-dimethylphenyl)benzo[e]benzothiophene-2-carboxamide Formula: C21H16ClNOS MolecularWeight: 365.87584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl)C

InChI

InChI=1S/C21H16ClNOS/c1-12-7-9-15(11-13(12)2)23-21(24)20-19(22)18-16-6-4-3-5-14(16)8-10-17(18)25-20/h3-11H,1-2H3,(H,23,24)