4-azanyl-N5-[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-N5-(4-methylpiperazin-1-yl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-N5-(4-methylpiperazin-1-yl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]-N5-(4-methylpiperazin-1-yl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[1-(cyclohexylamino)-1-oxopropan-2-yl]-N5-(4-methyl-1-piperazinyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[1-(cyclohexylamino)-1-oxopropan-2-yl]-5-N-(4-methylpiperazin-1-yl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclohexylamino)-2-keto-1-methyl-ethyl]-N'-(4-methylpiperazino)isothiazole-3,5-dicarboxamide Formula: C19H31N7O3S MolecularWeight: 437.55954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)N(C(=O)C2=C(C(=NS2)C(=O)N)N)N3CCN(CC3)C

Isomeric SMILES

CC(C(=O)NC1CCCCC1)N(C(=O)C2=C(C(=NS2)C(=O)N)N)N3CCN(CC3)C

InChI

InChI=1S/C19H31N7O3S/c1-12(18(28)22-13-6-4-3-5-7-13)26(25-10-8-24(2)9-11-25)19(29)16-14(20)15(17(21)27)23-30-16/h12-13H,3-11,20H2,1-2H3,(H2,21,27)(H,22,28)