2-chloranyl-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]-9-propan-2-yl-purin-6-amine

Systemtic Name: 2-chloranyl-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]-9-propan-2-yl-purin-6-amine Openeye Name: 2-chloro-9-isopropyl-N-[(2-phenylthiazol-5-yl)methyl]purin-6-amine CAS Name: 2-chloro-N-[(2-phenyl-5-thiazolyl)methyl]-9-propan-2-yl-6-purinamine IUPAC Name: 2-chloro-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]-9-propan-2-ylpurin-6-amine Traditional Name: (2-chloro-9-isopropyl-purin-6-yl)-[(2-phenylthiazol-5-yl)methyl]amine Formula: C18H17ClN6S MolecularWeight: 384.88578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=C(S3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=C(S3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C18H17ClN6S/c1-11(2)25-10-22-14-15(23-18(19)24-16(14)25)20-8-13-9-21-17(26-13)12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3,(H,20,23,24)