4-azanyl-N5-[(2R)-1-(cyclopentylamino)-1-oxidanylidene-butan-2-yl]-N5-(4-ethylphenyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(2R)-1-(cyclopentylamino)-1-oxidanylidene-butan-2-yl]-N5-(4-ethylphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1R)-1-(cyclopentylcarbamoyl)propyl]-N5-(4-ethylphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2R)-1-(cyclopentylamino)-1-oxobutan-2-yl]-N5-(4-ethylphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2R)-1-(cyclopentylamino)-1-oxobutan-2-yl]-5-N-(4-ethylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1R)-1-(cyclopentylcarbamoyl)propyl]-N'-(4-ethylphenyl)isothiazole-3,5-dicarboxamide Formula: C22H29N5O3S MolecularWeight: 443.56236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C(CC)C(=O)NC2CCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CCC1=CC=C(C=C1)N([C@H](CC)C(=O)NC2CCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C22H29N5O3S/c1-3-13-9-11-15(12-10-13)27(16(4-2)21(29)25-14-7-5-6-8-14)22(30)19-17(23)18(20(24)28)26-31-19/h9-12,14,16H,3-8,23H2,1-2H3,(H2,24,28)(H,25,29)/t16-/m1/s1