1,3-benzothiazol-2-ylmethyl-[(3R)-1-(4-ethanoylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(3R)-1-(4-ethanoylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-methyl-azanium Openeye Name: [(3R)-1-(4-acetylphenyl)-2,5-dioxo-pyrrolidin-3-yl]-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium CAS Name: [(3R)-1-(4-acetylphenyl)-2,5-dioxo-3-pyrrolidinyl]-(1,3-benzothiazol-2-ylmethyl)-methylammonium IUPAC Name: [(3R)-1-(4-acetylphenyl)-2,5-dioxopyrrolidin-3-yl]-(1,3-benzothiazol-2-ylmethyl)-methylazanium Traditional Name: [(3R)-1-(4-acetylphenyl)-2,5-diketo-pyrrolidin-3-yl]-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium Formula: C21H20N3O3S+ MolecularWeight: 394.4668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O3S/c1-13(25)14-7-9-15(10-8-14)24-20(26)11-17(21(24)27)23(2)12-19-22-16-5-3-4-6-18(16)28-19/h3-10,17H,11-12H2,1-2H3/p+1/t17-/m1/s1