3-azanyl-6-methyl-3-(phenylmethyl)-1,3-benzothiazol-3-ium-2-one

Systemtic Name: 3-azanyl-6-methyl-3-(phenylmethyl)-1,3-benzothiazol-3-ium-2-one Openeye Name: 3-amino-3-benzyl-6-methyl-1,3-benzothiazol-3-ium-2-one CAS Name: 3-amino-6-methyl-3-(phenylmethyl)-1,3-benzothiazol-3-ium-2-one IUPAC Name: 3-amino-3-benzyl-6-methyl-1,3-benzothiazol-3-ium-2-one Traditional Name: 3-amino-3-benzyl-6-methyl-1,3-benzothiazol-3-ium-2-one Formula: C15H15N2OS+ MolecularWeight: 271.3574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+](C(=O)S2)(CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC2=C(C=C1)[N+](C(=O)S2)(CC3=CC=CC=C3)N

InChI

InChI=1S/C15H15N2OS/c1-11-7-8-13-14(9-11)19-15(18)17(13,16)10-12-5-3-2-4-6-12/h2-9H,10,16H2,1H3/q+1