N-(4-methylpiperazin-1-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide hydrochloride

Systemtic Name: N-(4-methylpiperazin-1-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide hydrochloride Openeye Name: N-(4-methylpiperazin-1-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide hydrochloride CAS Name: N-(4-methyl-1-piperazinyl)-9,10,10-trioxo-3-thioxanthenecarboxamide hydrochloride IUPAC Name: N-(4-methylpiperazin-1-yl)-9,10,10-trioxothioxanthene-3-carboxamide hydrochloride Traditional Name: 9,10,10-triketo-N-(4-methylpiperazino)thioxanthene-3-carboxamide hydrochloride Formula: C19H20ClN3O4S MolecularWeight: 421.8978

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O.Cl

Isomeric SMILES

CN1CCN(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O.Cl

InChI

InChI=1S/C19H19N3O4S.ClH/c1-21-8-10-22(11-9-21)20-19(24)13-6-7-15-17(12-13)27(25,26)16-5-3-2-4-14(16)18(15)23;/h2-7,12H,8-11H2,1H3,(H,20,24);1H