(3R,4R)-6-azanyl-2-azanylidene-4-(6-chloranyl-1,3-benzodioxol-5-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile

Systemtic Name: (3R,4R)-6-azanyl-2-azanylidene-4-(6-chloranyl-1,3-benzodioxol-5-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile Openeye Name: (3R,4R)-6-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile CAS Name: (3R,4R)-6-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile IUPAC Name: (3R,4R)-6-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile Traditional Name: (3R,4R)-6-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile Formula: C14H9ClN4O2S MolecularWeight: 332.76486

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3C(C(=N)SC(=C3C#N)N)C#N)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)[C@@H]3[C@@H](C(=N)SC(=C3C#N)N)C#N)Cl

InChI

InChI=1S/C14H9ClN4O2S/c15-9-2-11-10(20-5-21-11)1-6(9)12-7(3-16)13(18)22-14(19)8(12)4-17/h1-2,7,12,18H,5,19H2/t7-,12+/m0/s1