N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-chloranyl-benzamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-chloranyl-benzamide Openeye Name: N-[1-(1,3-benzothiazol-2-ylmethylcarbamoyl)-3-methylsulfanyl-propyl]-2-chloro-benzamide CAS Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-(methylthio)-1-oxobutan-2-yl]-2-chlorobenzamide IUPAC Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-2-chlorobenzamide Traditional Name: N-[1-(1,3-benzothiazol-2-ylmethylcarbamoyl)-3-(methylthio)propyl]-2-chloro-benzamide Formula: C20H20ClN3O2S2 MolecularWeight: 433.9747

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCCC(C(=O)NCC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN3O2S2/c1-27-11-10-16(24-19(25)13-6-2-3-7-14(13)21)20(26)22-12-18-23-15-8-4-5-9-17(15)28-18/h2-9,16H,10-12H2,1H3,(H,22,26)(H,24,25)