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

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

Systemtic Name:1,3-benzothiazol-2-ylmethyl-[[2,3-bis(oxidanylidene)-5-propan-2-yl-indol-1-yl]methyl]-methyl-azanium
Openeye Name:1,3-benzothiazol-2-ylmethyl-[(5-isopropyl-2,3-dioxo-indolin-1-yl)methyl]-methyl-ammonium
CAS Name:1,3-benzothiazol-2-ylmethyl-[(2,3-dioxo-5-propan-2-yl-1-indolyl)methyl]-methylammonium
IUPAC Name:1,3-benzothiazol-2-ylmethyl-[(2,3-dioxo-5-propan-2-ylindol-1-yl)methyl]-methylazanium
Traditional Name:1,3-benzothiazol-2-ylmethyl-[(5-isopropyl-2,3-diketo-indolin-1-yl)methyl]-methyl-ammonium
Formula: C21H22N3O2S+
MolecularWeight: 380.48328
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H21N3O2S/c1-13(2)14-8-9-17-15(10-14)20(25)21(26)24(17)12-23(3)11-19-22-16-6-4-5-7-18(16)27-19/h4-10,13H,11-12H2,1-3H3/p+1


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