1-[2-[[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate

Systemtic Name: 1-[2-[[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate Openeye Name: 1-[2-[[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethyl]cyclopentanecarboxylate CAS Name: 1-[2-[[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl]-1-cyclopentanecarboxylate IUPAC Name: 1-[2-[[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl]cyclopentane-1-carboxylate Traditional Name: 1-[2-[[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-keto-ethyl]cyclopentanecarboxylate Formula: C18H21N2O3S- MolecularWeight: 345.43594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CC3(CCCC3)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)CC3(CCCC3)C(=O)[O-]

InChI

InChI=1S/C18H22N2O3S/c1-11-4-5-12-13(10-19)16(24-14(12)8-11)20-15(21)9-18(17(22)23)6-2-3-7-18/h11H,2-9H2,1H3,(H,20,21)(H,22,23)/p-1/t11-/m0/s1