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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(3R)-1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(3R)-2,5-dioxo-1-(p-tolyl)pyrrolidin-3-yl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(3R)-1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(3R)-1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(3R)-2,5-diketo-1-(p-tolyl)pyrrolidin-3-yl]-methyl-ammonium Formula: C20H20N3O2S+ MolecularWeight: 366.4567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O2S/c1-13-7-9-14(10-8-13)23-19(24)11-16(20(23)25)22(2)12-18-21-15-5-3-4-6-17(15)26-18/h3-10,16H,11-12H2,1-2H3/p+1/t16-/m1/s1