1-chloranyl-N-[1-(3-methoxyphenyl)ethyl]benzo[e][1]benzothiole-2-carboxamide

Systemtic Name: 1-chloranyl-N-[1-(3-methoxyphenyl)ethyl]benzo[e][1]benzothiole-2-carboxamide Openeye Name: 1-chloro-N-[1-(3-methoxyphenyl)ethyl]benzo[e]benzothiophene-2-carboxamide CAS Name: 1-chloro-N-[1-(3-methoxyphenyl)ethyl]-2-benzo[e][1]benzothiolecarboxamide IUPAC Name: 1-chloro-N-[1-(3-methoxyphenyl)ethyl]benzo[e][1]benzothiole-2-carboxamide Traditional Name: 1-chloro-N-[1-(3-methoxyphenyl)ethyl]benzo[e]benzothiophene-2-carboxamide Formula: C22H18ClNO2S MolecularWeight: 395.90182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClNO2S/c1-13(15-7-5-8-16(12-15)26-2)24-22(25)21-20(23)19-17-9-4-3-6-14(17)10-11-18(19)27-21/h3-13H,1-2H3,(H,24,25)