2,6-bis(azanyl)-4-(4-chlorophenyl)-5-(4-chlorophenyl)carbonyl-4H-thiopyran-3-carbonitrile

Systemtic Name: 2,6-bis(azanyl)-4-(4-chlorophenyl)-5-(4-chlorophenyl)carbonyl-4H-thiopyran-3-carbonitrile Openeye Name: 2,6-diamino-5-(4-chlorobenzoyl)-4-(4-chlorophenyl)-4H-thiopyran-3-carbonitrile CAS Name: 2,6-diamino-4-(4-chlorophenyl)-5-[(4-chlorophenyl)-oxomethyl]-4H-thiopyran-3-carbonitrile IUPAC Name: 2,6-diamino-5-(4-chlorobenzoyl)-4-(4-chlorophenyl)-4H-thiopyran-3-carbonitrile Traditional Name: 2,6-diamino-5-(4-chlorobenzoyl)-4-(4-chlorophenyl)-4H-thiopyran-3-carbonitrile Formula: C19H13Cl2N3OS MolecularWeight: 402.29702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C(=C(SC(=C2C(=O)C3=CC=C(C=C3)Cl)N)N)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2C(=C(SC(=C2C(=O)C3=CC=C(C=C3)Cl)N)N)C#N)Cl

InChI

InChI=1S/C19H13Cl2N3OS/c20-12-5-1-10(2-6-12)15-14(9-22)18(23)26-19(24)16(15)17(25)11-3-7-13(21)8-4-11/h1-8,15H,23-24H2