1,3-benzothiazol-2-ylmethyl-[1-[3-(cyclopropylcarbonylamino)phenyl]piperidin-4-yl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[1-[3-(cyclopropylcarbonylamino)phenyl]piperidin-4-yl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[1-[3-(cyclopropanecarbonylamino)phenyl]-4-piperidyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[1-[3-[[cyclopropyl(oxo)methyl]amino]phenyl]-4-piperidinyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[1-[3-(cyclopropanecarbonylamino)phenyl]piperidin-4-yl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[1-[3-(cyclopropanecarbonylamino)phenyl]-4-piperidyl]ammonium Formula: C23H27N4OS+ MolecularWeight: 407.55168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H26N4OS/c28-23(16-8-9-16)25-18-4-3-5-19(14-18)27-12-10-17(11-13-27)24-15-22-26-20-6-1-2-7-21(20)29-22/h1-7,14,16-17,24H,8-13,15H2,(H,25,28)/p+1