N-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methyl-propanamide

Systemtic Name: N-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methyl-propanamide Openeye Name: N-[2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methyl-propanamide CAS Name: N-[2-[[2-(4-chloroanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-2-methylpropanamide IUPAC Name: N-[2-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methylpropanamide Traditional Name: N-[2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]-2-methyl-propionamide Formula: C19H18ClN3O2S2 MolecularWeight: 419.94812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O2S2/c1-11(2)18(25)22-14-7-8-15-16(9-14)27-19(23-15)26-10-17(24)21-13-5-3-12(20)4-6-13/h3-9,11H,10H2,1-2H3,(H,21,24)(H,22,25)