[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-(2-phenyl-4-thiophen-2-yl-1,3-thiazol-5-yl)ethanoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-(2-phenyl-4-thiophen-2-yl-1,3-thiazol-5-yl)ethanoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-[2-phenyl-4-(2-thienyl)thiazol-5-yl]acetate CAS Name: 2-(2-phenyl-4-thiophen-2-yl-5-thiazolyl)acetic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-(2-phenyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetate Traditional Name: 2-[2-phenyl-4-(2-thienyl)thiazol-5-yl]acetic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)CC1=C(N=C(S1)C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)CC1=C(N=C(S1)C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C22H24N2O3S2/c1-15(2)10-11-23-19(25)14-27-20(26)13-18-21(17-9-6-12-28-17)24-22(29-18)16-7-4-3-5-8-16/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,23,25)