2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-[4-(4-methoxyphenyl)thiazol-2-yl]acetamide CAS Name: 2-[(6-amino-7H-purin-8-yl)thio]-N-[4-(4-methoxyphenyl)-2-thiazolyl]acetamide IUPAC Name: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-[(6-amino-7H-purin-8-yl)thio]-N-[4-(4-methoxyphenyl)thiazol-2-yl]acetamide Formula: C17H15N7O2S2 MolecularWeight: 413.4767

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC4=C(N3)C(=NC=N4)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC4=C(N3)C(=NC=N4)N

InChI

InChI=1S/C17H15N7O2S2/c1-26-10-4-2-9(3-5-10)11-6-27-16(21-11)22-12(25)7-28-17-23-13-14(18)19-8-20-15(13)24-17/h2-6,8H,7H2,1H3,(H,21,22,25)(H3,18,19,20,23,24)