S-[2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] ester IUPAC Name: S-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethyl] ester Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CSC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CSC(=O)C

InChI

InChI=1S/C18H16N2O2S2/c1-11-3-8-15-16(9-11)24-18(20-15)13-4-6-14(7-5-13)19-17(22)10-23-12(2)21/h3-9H,10H2,1-2H3,(H,19,22)