1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-pyrrolidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(5-nitro-3-propargyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Formula: C19H15ClN4O5S3 MolecularWeight: 510.9942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C#CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C19H15ClN4O5S3/c1-2-9-22-14-11-12(24(26)27)5-6-15(14)30-19(22)21-18(25)13-4-3-10-23(13)32(28,29)17-8-7-16(20)31-17/h1,5-8,11,13H,3-4,9-10H2