N-[2-methyl-5-(propanoylamino)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-[2-methyl-5-(propanoylamino)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-[2-methyl-5-(propanoylamino)phenyl]-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-[2-methyl-5-(1-oxopropylamino)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-[2-methyl-5-(propanoylamino)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(2-methyl-5-propionamido-phenyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O2S/c1-3-21(26)24-17-11-8-14(2)19(13-17)25-23(27)20-12-16-10-9-15-6-4-5-7-18(15)22(16)28-20/h4-8,11-13H,3,9-10H2,1-2H3,(H,24,26)(H,25,27)