(3R,4R)-6-azanyl-2-azanylidene-4-[(2S)-pentan-2-yl]-3,4-dihydrothiopyran-3,5-dicarbonitrile

Systemtic Name: (3R,4R)-6-azanyl-2-azanylidene-4-[(2S)-pentan-2-yl]-3,4-dihydrothiopyran-3,5-dicarbonitrile Openeye Name: (3R,4R)-6-amino-2-imino-4-[(1S)-1-methylbutyl]-3,4-dihydrothiopyran-3,5-dicarbonitrile CAS Name: (3R,4R)-6-amino-2-imino-4-[(2S)-pentan-2-yl]-3,4-dihydrothiopyran-3,5-dicarbonitrile IUPAC Name: (3R,4R)-6-amino-2-imino-4-[(2S)-pentan-2-yl]-3,4-dihydrothiopyran-3,5-dicarbonitrile Traditional Name: (3R,4R)-6-amino-2-imino-4-[(1S)-1-methylbutyl]-3,4-dihydrothiopyran-3,5-dicarbonitrile Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1C(C(=N)SC(=C1C#N)N)C#N

Isomeric SMILES

CCC[C@H](C)[C@@H]1[C@@H](C(=N)SC(=C1C#N)N)C#N

InChI

InChI=1S/C12H16N4S/c1-3-4-7(2)10-8(5-13)11(15)17-12(16)9(10)6-14/h7-8,10,15H,3-4,16H2,1-2H3/t7-,8-,10+/m0/s1