4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(2,5-dioxo-1-pyrrolidinyl)methyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-(succinimidomethyl)benzamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4C(=O)CCC4=O

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4C(=O)CCC4=O

InChI

InChI=1S/C21H19N3O3S/c1-2-13-5-8-16-17(11-13)28-21(22-16)23-20(27)15-6-3-14(4-7-15)12-24-18(25)9-10-19(24)26/h3-8,11H,2,9-10,12H2,1H3,(H,22,23,27)