ethyl 2-[[cyclohexyl(methylsulfonyl)carbamoyl]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[cyclohexyl(methylsulfonyl)carbamoyl]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[cyclohexyl(methylsulfonyl)carbamoyl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[[[cyclohexyl(methylsulfonyl)amino]-oxomethyl]amino]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclohexyl(methylsulfonyl)carbamoyl]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[cyclohexyl(mesyl)carbamoyl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C20H29N3O6S2 MolecularWeight: 471.59076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)NC(=O)N(C3CCCCC3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)NC(=O)N(C3CCCCC3)S(=O)(=O)C

InChI

InChI=1S/C20H29N3O6S2/c1-3-29-18(24)16-14-11-7-8-12-15(14)30-17(16)21-19(25)22-20(26)23(31(2,27)28)13-9-5-4-6-10-13/h13H,3-12H2,1-2H3,(H2,21,22,25,26)