4-azanyl-N5-[(1R)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N5-(4-ethoxyphenyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(1R)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N5-(4-ethoxyphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1R)-2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-N5-(4-ethoxyphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(1R)-2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-N5-(4-ethoxyphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(1R)-2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-5-N-(4-ethoxyphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1R)-2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl]-N'-p-phenetyl-isothiazole-3,5-dicarboxamide Formula: C25H28N6O4S MolecularWeight: 508.59262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C2=CC=NC=C2)C(=O)NC3CCCC3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N([C@H](C2=CC=NC=C2)C(=O)NC3CCCC3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C25H28N6O4S/c1-2-35-18-9-7-17(8-10-18)31(25(34)22-19(26)20(23(27)32)30-36-22)21(15-11-13-28-14-12-15)24(33)29-16-5-3-4-6-16/h7-14,16,21H,2-6,26H2,1H3,(H2,27,32)(H,29,33)/t21-/m1/s1