1-methyl-3-[[9-(4-methylphenyl)purin-6-yl]amino]thiourea

Systemtic Name: 1-methyl-3-[[9-(4-methylphenyl)purin-6-yl]amino]thiourea Openeye Name: 1-methyl-3-[[9-(p-tolyl)purin-6-yl]amino]thiourea CAS Name: 1-methyl-3-[[9-(4-methylphenyl)-6-purinyl]amino]thiourea IUPAC Name: 1-methyl-3-[[9-(4-methylphenyl)purin-6-yl]amino]thiourea Traditional Name: 1-methyl-3-[[9-(p-tolyl)purin-6-yl]amino]thiourea Formula: C14H15N7S MolecularWeight: 313.3808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NC3=C2N=CN=C3NNC(=S)NC

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NC3=C2N=CN=C3NNC(=S)NC

InChI

InChI=1S/C14H15N7S/c1-9-3-5-10(6-4-9)21-8-18-11-12(16-7-17-13(11)21)19-20-14(22)15-2/h3-8H,1-2H3,(H2,15,20,22)(H,16,17,19)