1-(3-methylphenyl)-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-methylphenyl)-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(m-tolyl)-5-[(1-piperidylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-methylphenyl)-5-[(1-piperidinylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-methylphenyl)-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(m-tolyl)-5-[(piperidinoamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=S

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=S

InChI

InChI=1S/C17H20N4O2S/c1-12-6-5-7-13(10-12)21-16(23)14(15(22)19-17(21)24)11-18-20-8-3-2-4-9-20/h5-7,10-11,18H,2-4,8-9H2,1H3,(H,19,22,24)