5,6-bis(2-methylpropyl)-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 5,6-bis(2-methylpropyl)-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5,6-diisobutyl-4-thioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5,6-bis(2-methylpropyl)-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile IUPAC Name: 5,6-bis(2-methylpropyl)-4-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 5,6-diisobutyl-4-thioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C15H20N4S MolecularWeight: 288.4111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C2=C(N1CC(C)C)C(=S)N=CN2)C#N

Isomeric SMILES

CC(C)CC1=C(C2=C(N1CC(C)C)C(=S)N=CN2)C#N

InChI

InChI=1S/C15H20N4S/c1-9(2)5-12-11(6-16)13-14(15(20)18-8-17-13)19(12)7-10(3)4/h8-10H,5,7H2,1-4H3,(H,17,18,20)