N-[4,7-bis(chloranyl)-1,3-benzothiazol-2-yl]-3-(4-methoxyphenyl)sulfonyl-propanamide

Systemtic Name: N-[4,7-bis(chloranyl)-1,3-benzothiazol-2-yl]-3-(4-methoxyphenyl)sulfonyl-propanamide Openeye Name: N-(4,7-dichloro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: N-(4,7-dichloro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide IUPAC Name: N-(4,7-dichloro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide Traditional Name: N-(4,7-dichloro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C17H14Cl2N2O4S2 MolecularWeight: 445.34006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(C=CC(=C3S2)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(C=CC(=C3S2)Cl)Cl

InChI

InChI=1S/C17H14Cl2N2O4S2/c1-25-10-2-4-11(5-3-10)27(23,24)9-8-14(22)20-17-21-15-12(18)6-7-13(19)16(15)26-17/h2-7H,8-9H2,1H3,(H,20,21,22)