4-[[4-azanyl-6-(2,4-dichlorophenyl)sulfanyl-1,3,5-triazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-(2,4-dichlorophenyl)sulfanyl-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-(2,4-dichlorophenyl)sulfanyl-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-[(2,4-dichlorophenyl)thio]-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-(2,4-dichlorophenyl)sulfanyl-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-[(2,4-dichlorophenyl)thio]-s-triazin-2-yl]amino]benzonitrile Formula: C16H10Cl2N6S MolecularWeight: 389.2618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC2=NC(=NC(=N2)N)SC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)NC2=NC(=NC(=N2)N)SC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H10Cl2N6S/c17-10-3-6-13(12(18)7-10)25-16-23-14(20)22-15(24-16)21-11-4-1-9(8-19)2-5-11/h1-7H,(H3,20,21,22,23,24)