ethyl 2-[2-[1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[1-methyl-2-oxo-2-(2-sec-butylanilino)ethyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[1-(2-butan-2-ylanilino)-1-oxopropan-2-yl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[1-(2-butan-2-ylanilino)-1-oxopropan-2-yl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-keto-1-methyl-2-(2-sec-butylanilino)ethyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NC(=CS2)CC(=O)OCC

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NC(=CS2)CC(=O)OCC

InChI

InChI=1S/C20H26N2O3S2/c1-5-13(3)16-9-7-8-10-17(16)22-19(24)14(4)27-20-21-15(12-26-20)11-18(23)25-6-2/h7-10,12-14H,5-6,11H2,1-4H3,(H,22,24)