5-ethyl-6-phenyl-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 5-ethyl-6-phenyl-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5-ethyl-6-phenyl-4-thioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5-ethyl-6-phenyl-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile IUPAC Name: 5-ethyl-6-phenyl-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 5-ethyl-6-phenyl-4-thioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C15H12N4S MolecularWeight: 280.34758

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=C1C(=S)N=CN2)C#N)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=C(C2=C1C(=S)N=CN2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C15H12N4S/c1-2-19-13(10-6-4-3-5-7-10)11(8-16)12-14(19)15(20)18-9-17-12/h3-7,9H,2H2,1H3,(H,17,18,20)