N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]butanamide

Systemtic Name: N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]butanamide Openeye Name: N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: N-[4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]phenyl]butanamide IUPAC Name: N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylphenyl]butanamide Traditional Name: N-[4-[[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethyl]thio]phenyl]butyramide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C20H21N3O2S2/c1-3-4-18(24)21-14-6-8-15(9-7-14)26-12-19(25)23-20-22-16-10-5-13(2)11-17(16)27-20/h5-11H,3-4,12H2,1-2H3,(H,21,24)(H,22,23,25)