N-(4-acetamido-3-chloranyl-phenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3)Cl

InChI

InChI=1S/C21H17ClN2O2S/c1-12(25)23-18-9-8-15(11-17(18)22)24-21(26)19-10-14-7-6-13-4-2-3-5-16(13)20(14)27-19/h2-5,8-11H,6-7H2,1H3,(H,23,25)(H,24,26)