1-(2-methoxyphenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(2-methoxyphenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(2-methoxyphenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2-methoxyphenyl)-5-[[(4-methyl-1-piperazinyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2-methoxyphenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(2-methoxyphenyl)-5-[[(4-methylpiperazino)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3OC

Isomeric SMILES

CN1CCN(CC1)NC=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3OC

InChI

InChI=1S/C17H21N5O3S/c1-20-7-9-21(10-8-20)18-11-12-15(23)19-17(26)22(16(12)24)13-5-3-4-6-14(13)25-2/h3-6,11,18H,7-10H2,1-2H3,(H,19,23,26)