[2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl] 2-[2-(3-thienyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-thiophenyl)-4-thiazolyl]acetic acid [2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(3-thienyl)thiazol-4-yl]acetic acid [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl] ester Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)COC(=O)CC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

C[C@@](C#N)(C1CC1)NC(=O)COC(=O)CC2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C17H17N3O3S2/c1-17(10-18,12-2-3-12)20-14(21)7-23-15(22)6-13-9-25-16(19-13)11-4-5-24-8-11/h4-5,8-9,12H,2-3,6-7H2,1H3,(H,20,21)/t17-/m1/s1