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

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

Click to see the large picture

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