4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)-N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: N-(6-nitro-3-propargyl-1,3-benzothiazol-2-ylidene)-4-succinimido-benzamide Formula: C21H14N4O5S MolecularWeight: 434.42466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O

InChI

InChI=1S/C21H14N4O5S/c1-2-11-23-16-8-7-15(25(29)30)12-17(16)31-21(23)22-20(28)13-3-5-14(6-4-13)24-18(26)9-10-19(24)27/h1,3-8,12H,9-11H2