methyl 2-[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: methyl 2-[(1S)-2-[(9-ethylcarbazol-3-yl)amino]-1-methyl-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[(2S)-1-[(9-ethyl-3-carbazolyl)amino]-1-oxopropan-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[(1S)-2-[(9-ethylcarbazol-3-yl)amino]-2-keto-1-methyl-ethyl]thio]acetic acid methyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SCC(=O)OC)C3=CC=CC=C31

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)[C@H](C)SCC(=O)OC)C3=CC=CC=C31

InChI

InChI=1S/C20H22N2O3S/c1-4-22-17-8-6-5-7-15(17)16-11-14(9-10-18(16)22)21-20(24)13(2)26-12-19(23)25-3/h5-11,13H,4,12H2,1-3H3,(H,21,24)/t13-/m0/s1