2-azanyl-4-[(4-chlorophenyl)methylsulfanyl]-6-thiophen-2-yl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[(4-chlorophenyl)methylsulfanyl]-6-thiophen-2-yl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[(4-chlorophenyl)methylsulfanyl]-6-(2-thienyl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[(4-chlorophenyl)methylthio]-6-thiophen-2-yl-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[(4-chlorophenyl)methylsulfanyl]-6-thiophen-2-ylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[(4-chlorobenzyl)thio]-6-(2-thienyl)pyrimidine-5-carbonitrile Formula: C16H11ClN4S2 MolecularWeight: 358.86834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(C(=NC(=N2)N)SCC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CSC(=C1)C2=C(C(=NC(=N2)N)SCC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C16H11ClN4S2/c17-11-5-3-10(4-6-11)9-23-15-12(8-18)14(20-16(19)21-15)13-2-1-7-22-13/h1-7H,9H2,(H2,19,20,21)