ethyl 3-[N-[(2-chloranylcyclohexyl)carbamoyl]-S-methyl-sulfinimidoyl]-6,7-dihydro-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl 3-[N-[(2-chloranylcyclohexyl)carbamoyl]-S-methyl-sulfinimidoyl]-6,7-dihydro-2-benzothiophene-1-carboxylate Openeye Name: ethyl 3-[N-[(2-chlorocyclohexyl)carbamoyl]-S-methyl-sulfinimidoyl]-6,7-dihydro-2-benzothiophene-1-carboxylate CAS Name: 3-[N-[[(2-chlorocyclohexyl)amino]-oxomethyl]-S-methylsulfinimidoyl]-6,7-dihydro-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[N-[(2-chlorocyclohexyl)carbamoyl]-S-methylsulfinimidoyl]-6,7-dihydro-2-benzothiophene-1-carboxylate Traditional Name: 3-[N-[(2-chlorocyclohexyl)carbamoyl]-S-methyl-sulfinimidoyl]-6,7-dihydroisobenzothiophene-1-carboxylic acid ethyl ester Formula: C19H25ClN2O3S2 MolecularWeight: 428.9964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCC=CC2=C(S1)S(=NC(=O)NC3CCCCC3Cl)C

Isomeric SMILES

CCOC(=O)C1=C2CCC=CC2=C(S1)/S(=N/C(=O)NC3CCCCC3Cl)/C

InChI

InChI=1S/C19H25ClN2O3S2/c1-3-25-17(23)16-12-8-4-5-9-13(12)18(26-16)27(2)22-19(24)21-15-11-7-6-10-14(15)20/h5,9,14-15H,3-4,6-8,10-11H2,1-2H3,(H,21,24)