N-[4,7-bis(chloranyl)-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[4,7-bis(chloranyl)-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[4,7-dichloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-[4,7-dichloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[4,7-dichloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-[4,7-dichloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-(2-thienylsulfonyl)pipecolinamide Formula: C20H21Cl2N3O4S3 MolecularWeight: 534.49944

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)Cl)Cl

Isomeric SMILES

COCCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O4S3/c1-29-11-10-24-17-13(21)7-8-14(22)18(17)31-20(24)23-19(26)15-5-2-3-9-25(15)32(27,28)16-6-4-12-30-16/h4,6-8,12,15H,2-3,5,9-11H2,1H3