(4,6-dimethyl-3H-1,3-benzothiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)azanium

Systemtic Name: (4,6-dimethyl-3H-1,3-benzothiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)azanium Openeye Name: (4,6-dimethyl-3H-1,3-benzothiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ammonium CAS Name: (4,6-dimethyl-3H-1,3-benzothiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ammonium IUPAC Name: (4,6-dimethyl-3H-1,3-benzothiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)azanium Traditional Name: (4,6-dimethyl-3H-1,3-benzothiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ammonium Formula: C15H20N3S+ MolecularWeight: 274.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=[NH+]C3=NCCCCC3)N2)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=[NH+]C3=NCCCCC3)N2)C

InChI

InChI=1S/C15H19N3S/c1-10-8-11(2)14-12(9-10)19-15(18-14)17-13-6-4-3-5-7-16-13/h8-9H,3-7H2,1-2H3,(H,16,17,18)/p+1