N-aminocarbonyl-2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-3-methyl-butanamide

Systemtic Name: N-aminocarbonyl-2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-3-methyl-butanamide Openeye Name: N-carbamoyl-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-3-methyl-butanamide CAS Name: N-carbamoyl-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-3-methylbutanamide IUPAC Name: N-carbamoyl-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-3-methylbutanamide Traditional Name: N-carbamoyl-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-3-methyl-butyramide Formula: C13H14ClN3O2S2 MolecularWeight: 343.85216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NC2=C(S1)C=CC(=C2)Cl

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=NC2=C(S1)C=CC(=C2)Cl

InChI

InChI=1S/C13H14ClN3O2S2/c1-6(2)10(11(18)17-12(15)19)21-13-16-8-5-7(14)3-4-9(8)20-13/h3-6,10H,1-2H3,(H3,15,17,18,19)