S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)N(CC1=CC=CC=C1)C2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC(=O)SCC(=O)N(CC1=CC=CC=C1)C2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C19H18N2O3S2/c1-13(22)25-12-18(23)21(11-14-6-4-3-5-7-14)19-20-16-9-8-15(24-2)10-17(16)26-19/h3-10H,11-12H2,1-2H3