(5S)-1-(2-chlorophenyl)-5-(2-piperidin-1-ylethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-1-(2-chlorophenyl)-5-(2-piperidin-1-ylethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-1-(2-chlorophenyl)-5-[2-(1-piperidyl)ethyliminomethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-1-(2-chlorophenyl)-5-[2-(1-piperidinyl)ethyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-1-(2-chlorophenyl)-5-(2-piperidin-1-ylethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-1-(2-chlorophenyl)-5-(2-piperidinoethyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H21ClN4O2S MolecularWeight: 392.90294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN=CC2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(CC1)CCN=C[C@H]2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H21ClN4O2S/c19-14-6-2-3-7-15(14)23-17(25)13(16(24)21-18(23)26)12-20-8-11-22-9-4-1-5-10-22/h2-3,6-7,12-13H,1,4-5,8-11H2,(H,21,24,26)/t13-/m0/s1