1,3-benzothiazol-2-ylmethyl-[[5-ethyl-2,3-bis(oxidanylidene)indol-1-yl]methyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[[5-ethyl-2,3-bis(oxidanylidene)indol-1-yl]methyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(5-ethyl-2,3-dioxo-indolin-1-yl)methyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(5-ethyl-2,3-dioxo-1-indolyl)methyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(5-ethyl-2,3-dioxoindol-1-yl)methyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(5-ethyl-2,3-diketo-indolin-1-yl)methyl]-methyl-ammonium Formula: C20H20N3O2S+ MolecularWeight: 366.4567

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O2S/c1-3-13-8-9-16-14(10-13)19(24)20(25)23(16)12-22(2)11-18-21-15-6-4-5-7-17(15)26-18/h4-10H,3,11-12H2,1-2H3/p+1