[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl-(3-pyridylmethyl)ammonium CAS Name: [1-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrrolyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl-(3-pyridylmethyl)ammonium Formula: C19H19N4S+ MolecularWeight: 335.44596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3C[NH2+]CC4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3C[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C19H18N4S/c1-14-6-7-17-18(10-14)24-19(22-17)23-9-3-5-16(23)13-21-12-15-4-2-8-20-11-15/h2-11,21H,12-13H2,1H3/p+1