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2-(azepan-1-ium-1-yl)-N-[(Z)-(4-methylsulfanylphenyl)methylideneamino]ethanamide

2-(azepan-1-ium-1-yl)-N-[(Z)-(4-methylsulfanylphenyl)methylideneamino]ethanamide

Systemtic Name:2-(azepan-1-ium-1-yl)-N-[(Z)-(4-methylsulfanylphenyl)methylideneamino]ethanamide
Openeye Name:2-(azepan-1-ium-1-yl)-N-[(Z)-(4-methylsulfanylphenyl)methyleneamino]acetamide
CAS Name:2-(1-azepan-1-iumyl)-N-[(Z)-[4-(methylthio)phenyl]methylideneamino]acetamide
IUPAC Name:2-(azepan-1-ium-1-yl)-N-[(Z)-(4-methylsulfanylphenyl)methylideneamino]acetamide
Traditional Name:2-(azepan-1-ium-1-yl)-N-[(Z)-[4-(methylthio)benzylidene]amino]acetamide
Formula: C16H24N3OS+
MolecularWeight: 306.44626
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=NNC(=O)C[NH+]2CCCCCC2


Isomeric SMILES

CSC1=CC=C(C=C1)/C=N\NC(=O)C[NH+]2CCCCCC2


InChI

InChI=1S/C16H23N3OS/c1-21-15-8-6-14(7-9-15)12-17-18-16(20)13-19-10-4-2-3-5-11-19/h6-9,12H,2-5,10-11,13H2,1H3,(H,18,20)/p+1/b17-12-


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