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

Systemtic Name: S-[1-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-1-oxidanylidene-butan-2-yl] ethanethioate Openeye Name: S-[1-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]propyl] ethanethioate CAS Name: ethanethioic acid S-[1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl] ester IUPAC Name: S-[1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[1-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]propyl] ester Formula: C20H20N2O2S2 MolecularWeight: 384.515

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C)SC(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C)SC(=O)C

InChI

InChI=1S/C20H20N2O2S2/c1-4-17(25-13(3)23)19(24)21-15-8-6-14(7-9-15)20-22-16-10-5-12(2)11-18(16)26-20/h5-11,17H,4H2,1-3H3,(H,21,24)