N-(3-azanylpyridin-2-yl)-N'-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]heptanediamide

Systemtic Name: N-(3-azanylpyridin-2-yl)-N'-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]heptanediamide Openeye Name: N-(3-amino-2-pyridyl)-N'-[4-(4-methoxyphenyl)thiazol-2-yl]heptanediamide CAS Name: N-(3-amino-2-pyridinyl)-N'-[4-(4-methoxyphenyl)-2-thiazolyl]heptanediamide IUPAC Name: N-(3-aminopyridin-2-yl)-N'-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]heptanediamide Traditional Name: N-(3-amino-2-pyridyl)-N'-[4-(4-methoxyphenyl)thiazol-2-yl]pimelamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCCCC(=O)NC3=C(C=CC=N3)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCCCC(=O)NC3=C(C=CC=N3)N

InChI

InChI=1S/C22H25N5O3S/c1-30-16-11-9-15(10-12-16)18-14-31-22(25-18)27-20(29)8-4-2-3-7-19(28)26-21-17(23)6-5-13-24-21/h5-6,9-14H,2-4,7-8,23H2,1H3,(H,24,26,28)(H,25,27,29)