S-(dimethylamino) N-[[(Z)-(1-methyl-5-oxidanylidene-pyridin-1-ium-2-ylidene)methyl]amino]carbamothioate

Systemtic Name: S-(dimethylamino) N-[[(Z)-(1-methyl-5-oxidanylidene-pyridin-1-ium-2-ylidene)methyl]amino]carbamothioate Openeye Name: S-(dimethylamino) N-[[(Z)-(1-methyl-5-oxo-pyridin-1-ium-2-ylidene)methyl]amino]carbamothioate CAS Name: N-[[(Z)-(1-methyl-5-oxo-2-pyridin-1-iumylidene)methyl]amino]carbamothioic acid S-(dimethylamino) ester IUPAC Name: S-(dimethylamino) N-[[(Z)-(1-methyl-5-oxopyridin-1-ium-2-ylidene)methyl]amino]carbamothioate Traditional Name: N-[[(Z)-(5-keto-1-methyl-pyridin-1-ium-2-ylidene)methyl]amino]thiocarbamic acid S-(dimethylamino) ester Formula: C10H15N4O2S+ MolecularWeight: 255.3167

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=O)C=CC1=CNNC(=O)SN(C)C

Isomeric SMILES

C[N+]\1=CC(=O)C=C/C1=C/NNC(=O)SN(C)C

InChI

InChI=1S/C10H14N4O2S/c1-13(2)17-10(16)12-11-6-8-4-5-9(15)7-14(8)3/h4-7,15H,1-3H3/p+1/b8-6-