2-[9-(phenylmethyl)purin-6-yl]sulfanylaniline

Systemtic Name: 2-[9-(phenylmethyl)purin-6-yl]sulfanylaniline Openeye Name: 2-(9-benzylpurin-6-yl)sulfanylaniline CAS Name: 2-[[9-(phenylmethyl)-6-purinyl]thio]aniline IUPAC Name: 2-(9-benzylpurin-6-yl)sulfanylaniline Traditional Name: [2-[(9-benzylpurin-6-yl)thio]phenyl]amine Formula: C18H15N5S MolecularWeight: 333.4102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3SC4=CC=CC=C4N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3SC4=CC=CC=C4N

InChI

InChI=1S/C18H15N5S/c19-14-8-4-5-9-15(14)24-18-16-17(20-11-21-18)23(12-22-16)10-13-6-2-1-3-7-13/h1-9,11-12H,10,19H2