6-azanyl-2,4-bis(4-chlorophenyl)-3,5-dicyano-2,4-dihydrothiopyran-3-carbothioamide

Systemtic Name: 6-azanyl-2,4-bis(4-chlorophenyl)-3,5-dicyano-2,4-dihydrothiopyran-3-carbothioamide Openeye Name: 6-amino-2,4-bis(4-chlorophenyl)-3,5-dicyano-2,4-dihydrothiopyran-3-carbothioamide CAS Name: 6-amino-2,4-bis(4-chlorophenyl)-3,5-dicyano-2,4-dihydrothiopyran-3-carbothioamide IUPAC Name: 6-amino-2,4-bis(4-chlorophenyl)-3,5-dicyano-2,4-dihydrothiopyran-3-carbothioamide Traditional Name: 6-amino-2,4-bis(4-chlorophenyl)-3,5-dicyano-2,4-dihydrothiopyran-3-carbothioamide Formula: C20H14Cl2N4S2 MolecularWeight: 445.38796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C(=C(SC(C2(C#N)C(=S)N)C3=CC=C(C=C3)Cl)N)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2C(=C(SC(C2(C#N)C(=S)N)C3=CC=C(C=C3)Cl)N)C#N)Cl

InChI

InChI=1S/C20H14Cl2N4S2/c21-13-5-1-11(2-6-13)16-15(9-23)18(25)28-17(20(16,10-24)19(26)27)12-3-7-14(22)8-4-12/h1-8,16-17H,25H2,(H2,26,27)