N-(4-chloranyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: N-(4-chloranyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: 4-benzylsulfonyl-N-(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: N-(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: 4-benzylsulfonyl-N-(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-benzylsulfonyl-N-(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C19H19ClN2O3S2 MolecularWeight: 422.94876

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2Cl)SC1=NC(=O)CCCS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=CC=C2Cl)SC1=NC(=O)CCCS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H19ClN2O3S2/c1-22-18-15(20)9-5-10-16(18)26-19(22)21-17(23)11-6-12-27(24,25)13-14-7-3-2-4-8-14/h2-5,7-10H,6,11-13H2,1H3