N-[4,7-bis(chloranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[4,7-bis(chloranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-(4,7-dichloro-3-propargyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C19H15Cl2N3O3S3 MolecularWeight: 500.4417

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)Cl)Cl

Isomeric SMILES

C#CCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)Cl)Cl

InChI

InChI=1S/C19H15Cl2N3O3S3/c1-2-9-23-16-12(20)7-8-13(21)17(16)29-19(23)22-18(25)14-5-3-10-24(14)30(26,27)15-6-4-11-28-15/h1,4,6-8,11,14H,3,5,9-10H2