4-(diethoxymethyl)-5-[(pyridin-4-ylamino)methyl]-1,3-dithiol-2-one

Systemtic Name: 4-(diethoxymethyl)-5-[(pyridin-4-ylamino)methyl]-1,3-dithiol-2-one Openeye Name: 4-(diethoxymethyl)-5-[(4-pyridylamino)methyl]-1,3-dithiol-2-one CAS Name: 4-(diethoxymethyl)-5-[(pyridin-4-ylamino)methyl]-1,3-dithiol-2-one IUPAC Name: 4-(diethoxymethyl)-5-[(pyridin-4-ylamino)methyl]-1,3-dithiol-2-one Traditional Name: 4-(diethoxymethyl)-5-[(4-pyridylamino)methyl]-1,3-dithiol-2-one Formula: C14H18N2O3S2 MolecularWeight: 326.43432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(SC(=O)S1)CNC2=CC=NC=C2)OCC

Isomeric SMILES

CCOC(C1=C(SC(=O)S1)CNC2=CC=NC=C2)OCC

InChI

InChI=1S/C14H18N2O3S2/c1-3-18-13(19-4-2)12-11(20-14(17)21-12)9-16-10-5-7-15-8-6-10/h5-8,13H,3-4,9H2,1-2H3,(H,15,16)