4-azanyl-7-[(4-methoxyphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbothioamide

Systemtic Name: 4-azanyl-7-[(4-methoxyphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbothioamide Openeye Name: 4-amino-7-[(4-methoxyphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbothioamide CAS Name: 4-amino-7-[(4-methoxyphenyl)methyl]-5-pyrrolo[2,3-d]pyrimidinecarbothioamide IUPAC Name: 4-amino-7-[(4-methoxyphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbothioamide Traditional Name: 4-amino-7-p-anisyl-pyrrolo[2,3-d]pyrimidine-5-carbothioamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=C(C3=C2N=CN=C3N)C(=S)N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=C(C3=C2N=CN=C3N)C(=S)N

InChI

InChI=1S/C15H15N5OS/c1-21-10-4-2-9(3-5-10)6-20-7-11(14(17)22)12-13(16)18-8-19-15(12)20/h2-5,7-8H,6H2,1H3,(H2,17,22)(H2,16,18,19)