(5-ethanoyl-4-methyl-3H-1,3-thiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)azanium

Systemtic Name: (5-ethanoyl-4-methyl-3H-1,3-thiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)azanium Openeye Name: (5-acetyl-4-methyl-3H-thiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ammonium CAS Name: (5-acetyl-4-methyl-3H-thiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ammonium IUPAC Name: (5-acetyl-4-methyl-3H-1,3-thiazol-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)azanium Traditional Name: (5-acetyl-4-methyl-4-thiazolin-2-ylidene)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ammonium Formula: C12H18N3OS+ MolecularWeight: 252.35582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=[NH+]C2=NCCCCC2)N1)C(=O)C

Isomeric SMILES

CC1=C(SC(=[NH+]C2=NCCCCC2)N1)C(=O)C

InChI

InChI=1S/C12H17N3OS/c1-8-11(9(2)16)17-12(14-8)15-10-6-4-3-5-7-13-10/h3-7H2,1-2H3,(H,13,14,15)/p+1