1-chloranyl-N-(4-ethylphenyl)benzo[e][1]benzothiole-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C21H16ClNOS/c1-2-13-7-10-15(11-8-13)23-21(24)20-19(22)18-16-6-4-3-5-14(16)9-12-17(18)25-20/h3-12H,2H2,1H3,(H,23,24)