cyclopentyl-dimethyl-[2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopentyl-dimethyl-[2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopentyl-dimethyl-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxo-ethyl]ammonium CAS Name: cyclopentyl-dimethyl-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]ammonium IUPAC Name: cyclopentyl-dimethyl-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]azanium Traditional Name: cyclopentyl-[2-keto-2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethyl]-dimethyl-ammonium Formula: C23H28N3OS+ MolecularWeight: 394.55292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C[N+](C)(C)C4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C[N+](C)(C)C4CCCC4

InChI

InChI=1S/C23H27N3OS/c1-16-8-13-20-21(14-16)28-23(25-20)17-9-11-18(12-10-17)24-22(27)15-26(2,3)19-6-4-5-7-19/h8-14,19H,4-7,15H2,1-3H3/p+1