4-azanyl-N3-cyclohexyl-N5-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-N5-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N3-cyclohexyl-N5-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-N5-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-benzyl-N3-cyclohexyl-N5-[2-(cyclohexylamino)-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N3-cyclohexyl-N5-[2-(cyclohexylamino)-2-oxoethyl]-N5-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-benzyl-3-N-cyclohexyl-5-N-[2-(cyclohexylamino)-2-oxoethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-benzyl-N-cyclohexyl-N'-[2-(cyclohexylamino)-2-keto-ethyl]isothiazole-3,5-dicarboxamide Formula: C26H35N5O3S MolecularWeight: 497.6528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)NC4CCCCC4)N

Isomeric SMILES

C1CCC(CC1)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)NC4CCCCC4)N

InChI

InChI=1S/C26H35N5O3S/c27-22-23(25(33)29-20-14-8-3-9-15-20)30-35-24(22)26(34)31(16-18-10-4-1-5-11-18)17-21(32)28-19-12-6-2-7-13-19/h1,4-5,10-11,19-20H,2-3,6-9,12-17,27H2,(H,28,32)(H,29,33)