1-(3-chlorophenyl)-5-[3-(diethylamino)propyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-chlorophenyl)-5-[3-(diethylamino)propyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chlorophenyl)-5-[3-(diethylamino)propyliminomethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chlorophenyl)-5-[3-(diethylamino)propyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chlorophenyl)-5-[3-(diethylamino)propyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chlorophenyl)-5-[3-(diethylamino)propyliminomethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H23ClN4O2S MolecularWeight: 394.91882

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN=CC1C(=O)NC(=S)N(C1=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCN(CC)CCCN=CC1C(=O)NC(=S)N(C1=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H23ClN4O2S/c1-3-22(4-2)10-6-9-20-12-15-16(24)21-18(26)23(17(15)25)14-8-5-7-13(19)11-14/h5,7-8,11-12,15H,3-4,6,9-10H2,1-2H3,(H,21,24,26)