2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-[[2-(cyclopropylamino)-2-oxoethyl]thio]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3SCC(=O)NC4CC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3SCC(=O)NC4CC4

InChI

InChI=1S/C20H19N3O2S2/c1-12-6-9-15-17(10-12)27-20(22-15)23-19(25)14-4-2-3-5-16(14)26-11-18(24)21-13-7-8-13/h2-6,9-10,13H,7-8,11H2,1H3,(H,21,24)(H,22,23,25)