[2-acetyloxy-1-(1,3-benzothiazol-2-yl)-3-(6-methylheptan-2-ylamino)-3-oxidanylidene-propyl] ethanoate

Systemtic Name: [2-acetyloxy-1-(1,3-benzothiazol-2-yl)-3-(6-methylheptan-2-ylamino)-3-oxidanylidene-propyl] ethanoate Openeye Name: [2-acetoxy-1-(1,3-benzothiazol-2-yl)-3-(1,5-dimethylhexylamino)-3-oxo-propyl] acetate CAS Name: acetic acid [2-acetyloxy-1-(1,3-benzothiazol-2-yl)-3-(6-methylheptan-2-ylamino)-3-oxopropyl] ester IUPAC Name: [2-acetyloxy-1-(1,3-benzothiazol-2-yl)-3-(6-methylheptan-2-ylamino)-3-oxopropyl] acetate Traditional Name: acetic acid [2-acetoxy-1-(1,3-benzothiazol-2-yl)-3-(1,5-dimethylhexylamino)-3-keto-propyl] ester Formula: C22H30N2O5S MolecularWeight: 434.549

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C(C(C1=NC2=CC=CC=C2S1)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C(C(C1=NC2=CC=CC=C2S1)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H30N2O5S/c1-13(2)9-8-10-14(3)23-21(27)19(28-15(4)25)20(29-16(5)26)22-24-17-11-6-7-12-18(17)30-22/h6-7,11-14,19-20H,8-10H2,1-5H3,(H,23,27)