1-phenyl-4-[(phenylmethyl)amino]-6-sulfanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 1-phenyl-4-[(phenylmethyl)amino]-6-sulfanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-(benzylamino)-1-phenyl-6-thioxo-pyrimidine-5-carbonitrile CAS Name: 1-phenyl-4-[(phenylmethyl)amino]-6-sulfanylidene-5-pyrimidinecarbonitrile IUPAC Name: 4-(benzylamino)-1-phenyl-6-sulfanylidenepyrimidine-5-carbonitrile Traditional Name: 4-(benzylamino)-1-phenyl-6-thioxo-pyrimidine-5-carbonitrile Formula: C18H14N4S MolecularWeight: 318.39556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=S)N(C=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=S)N(C=N2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H14N4S/c19-11-16-17(20-12-14-7-3-1-4-8-14)21-13-22(18(16)23)15-9-5-2-6-10-15/h1-10,13,20H,12H2