ethyl 2-[2-[2-(4-aminophenyl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-aminophenyl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-aminophenyl)sulfanylbutanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-[(4-aminophenyl)thio]-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-aminophenyl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[(4-aminophenyl)thio]butanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)SC2=CC=C(C=C2)N

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)SC2=CC=C(C=C2)N

InChI

InChI=1S/C17H21N3O3S2/c1-3-14(25-13-7-5-11(18)6-8-13)16(22)20-17-19-12(10-24-17)9-15(21)23-4-2/h5-8,10,14H,3-4,9,18H2,1-2H3,(H,19,20,22)