1,3-benzothiazol-2-ylmethyl-methyl-[2-[[4-(4-methylpiperidin-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-[[4-(4-methylpiperidin-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-[4-(4-methyl-1-piperidyl)anilino]-2-oxo-ethyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-[4-(4-methyl-1-piperidinyl)anilino]-2-oxoethyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-[4-(4-methylpiperidin-1-yl)anilino]-2-oxoethyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-keto-2-[4-(4-methylpiperidino)anilino]ethyl]-methyl-ammonium Formula: C23H29N4OS+ MolecularWeight: 409.56756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H28N4OS/c1-17-11-13-27(14-12-17)19-9-7-18(8-10-19)24-22(28)15-26(2)16-23-25-20-5-3-4-6-21(20)29-23/h3-10,17H,11-16H2,1-2H3,(H,24,28)/p+1