1,3-benzothiazol-2-ylmethyl-[[4,6-dimethyl-2,3-bis(oxidanylidene)indol-1-yl]methyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[[4,6-dimethyl-2,3-bis(oxidanylidene)indol-1-yl]methyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(4,6-dimethyl-2,3-dioxo-indolin-1-yl)methyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(4,6-dimethyl-2,3-dioxo-1-indolyl)methyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(4,6-dimethyl-2,3-dioxoindol-1-yl)methyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(2,3-diketo-4,6-dimethyl-indolin-1-yl)methyl]-methyl-ammonium Formula: C20H20N3O2S+ MolecularWeight: 366.4567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N(C(=O)C2=O)C[NH+](C)CC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N(C(=O)C2=O)C[NH+](C)CC3=NC4=CC=CC=C4S3)C

InChI

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