4-azanyl-N5-(4-cyclohexylphenyl)-N5-[1-oxidanylidene-1-(oxolan-2-ylmethylamino)propan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(4-cyclohexylphenyl)-N5-[1-oxidanylidene-1-(oxolan-2-ylmethylamino)propan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(4-cyclohexylphenyl)-N5-[1-methyl-2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(4-cyclohexylphenyl)-N5-[1-oxo-1-(2-oxolanylmethylamino)propan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(4-cyclohexylphenyl)-5-N-[1-oxo-1-(oxolan-2-ylmethylamino)propan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(4-cyclohexylphenyl)-N'-[2-keto-1-methyl-2-(tetrahydrofurfurylamino)ethyl]isothiazole-3,5-dicarboxamide Formula: C25H33N5O4S MolecularWeight: 499.62562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCO1)N(C2=CC=C(C=C2)C3CCCCC3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

CC(C(=O)NCC1CCCO1)N(C2=CC=C(C=C2)C3CCCCC3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C25H33N5O4S/c1-15(24(32)28-14-19-8-5-13-34-19)30(25(33)22-20(26)21(23(27)31)29-35-22)18-11-9-17(10-12-18)16-6-3-2-4-7-16/h9-12,15-16,19H,2-8,13-14,26H2,1H3,(H2,27,31)(H,28,32)