2-(2-azanyl-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-N-(3-cyanophenyl)ethanamide

Systemtic Name: 2-(2-azanyl-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-N-(3-cyanophenyl)ethanamide Openeye Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-N-(3-cyanophenyl)acetamide CAS Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-N-(3-cyanophenyl)acetamide IUPAC Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-N-(3-cyanophenyl)acetamide Traditional Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-N-(3-cyanophenyl)acetamide Formula: C17H15N4O2S+ MolecularWeight: 339.3916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=C(S2)N)CC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=C(S2)N)CC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H14N4O2S/c1-23-13-5-6-14-15(8-13)24-17(19)21(14)10-16(22)20-12-4-2-3-11(7-12)9-18/h2-8,19H,10H2,1H3,(H,20,22)/p+1