2-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-4,5-dimethoxy-N,N-dimethyl-benzamide

Systemtic Name: 2-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-4,5-dimethoxy-N,N-dimethyl-benzamide Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-4,5-dimethoxy-N,N-dimethyl-benzamide CAS Name: 2-[[2-(1,3-benzothiazol-2-ylmethylthio)-1-oxoethyl]amino]-4,5-dimethoxy-N,N-dimethylbenzamide IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-4,5-dimethoxy-N,N-dimethylbenzamide Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylmethylthio)acetyl]amino]-4,5-dimethoxy-N,N-dimethyl-benzamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=C(C=C1NC(=O)CSCC2=NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

CN(C)C(=O)C1=CC(=C(C=C1NC(=O)CSCC2=NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C21H23N3O4S2/c1-24(2)21(26)13-9-16(27-3)17(28-4)10-15(13)22-19(25)11-29-12-20-23-14-7-5-6-8-18(14)30-20/h5-10H,11-12H2,1-4H3,(H,22,25)