N-(6-azanyl-1,3-benzothiazol-2-yl)-3-thiomorpholin-4-ium-4-yl-propanamide

Systemtic Name: N-(6-azanyl-1,3-benzothiazol-2-yl)-3-thiomorpholin-4-ium-4-yl-propanamide Openeye Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-thiomorpholin-4-ium-4-yl-propanamide CAS Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-(4-thiomorpholin-4-iumyl)propanamide IUPAC Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-thiomorpholin-4-ium-4-ylpropanamide Traditional Name: N-(6-amino-1,3-benzothiazol-2-yl)-3-thiomorpholin-4-ium-4-yl-propionamide Formula: C14H19N4OS2+ MolecularWeight: 323.45686

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CCC(=O)NC2=NC3=C(S2)C=C(C=C3)N

Isomeric SMILES

C1CSCC[NH+]1CCC(=O)NC2=NC3=C(S2)C=C(C=C3)N

InChI

InChI=1S/C14H18N4OS2/c15-10-1-2-11-12(9-10)21-14(16-11)17-13(19)3-4-18-5-7-20-8-6-18/h1-2,9H,3-8,15H2,(H,16,17,19)/p+1