5-[[[1-(phenylmethyl)piperidin-4-yl]amino]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[[1-(phenylmethyl)piperidin-4-yl]amino]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[[(1-benzyl-4-piperidyl)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[[1-(phenylmethyl)-4-piperidinyl]amino]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[(1-benzylpiperidin-4-yl)amino]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[[(1-benzyl-4-piperidyl)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CNC2CCN(CC2)CC3=CC=CC=C3)C(=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CNC2CCN(CC2)CC3=CC=CC=C3)C(=O)NC1=S

InChI

InChI=1S/C20H24N4O2S/c1-2-10-24-19(26)17(18(25)22-20(24)27)13-21-16-8-11-23(12-9-16)14-15-6-4-3-5-7-15/h2-7,13,16,21H,1,8-12,14H2,(H,22,25,27)