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

Systemtic Name: N-[4,7-bis(chloranyl)-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[4,7-dichloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-[4,7-dichloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[4,7-dichloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-[4,7-dichloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-1-(2-thienylsulfonyl)pipecolinamide Formula: C21H23Cl2N3O4S3 MolecularWeight: 548.52602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)Cl)Cl

Isomeric SMILES

CCOCCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O4S3/c1-2-30-12-11-25-18-14(22)8-9-15(23)19(18)32-21(25)24-20(27)16-6-3-4-10-26(16)33(28,29)17-7-5-13-31-17/h5,7-9,13,16H,2-4,6,10-12H2,1H3