[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-benzamido-4-methyl-pentanoate

Systemtic Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-benzamido-4-methyl-pentanoate Openeye Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-benzamido-4-methyl-pentanoate CAS Name: 2-benzamido-4-methylpentanoic acid [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-benzamido-4-methylpentanoate Traditional Name: 2-benzamido-4-methyl-valeric acid [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)COC(=O)C(CC(C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)COC(=O)C(CC(C)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O5S/c1-4-31-17-10-11-18-20(13-17)33-24(26-18)27-21(28)14-32-23(30)19(12-15(2)3)25-22(29)16-8-6-5-7-9-16/h5-11,13,15,19H,4,12,14H2,1-3H3,(H,25,29)(H,26,27,28)