(5E)-1-butyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-butyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-butyl-5-[[[2-(3-pyridyl)-1-piperidyl]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-butyl-5-[[[2-(3-pyridinyl)-1-piperidinyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-butyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-butyl-5-[[[2-(3-pyridyl)piperidino]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CNN2CCCCC2C3=CN=CC=C3)C(=O)NC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C/NN2CCCCC2C3=CN=CC=C3)/C(=O)NC1=S

InChI

InChI=1S/C19H25N5O2S/c1-2-3-10-23-18(26)15(17(25)22-19(23)27)13-21-24-11-5-4-8-16(24)14-7-6-9-20-12-14/h6-7,9,12-13,16,21H,2-5,8,10-11H2,1H3,(H,22,25,27)/b15-13+