2-methylsulfanyl-4-[(phenylmethyl)amino]pyrimidine-5-carbaldehyde

Systemtic Name: 2-methylsulfanyl-4-[(phenylmethyl)amino]pyrimidine-5-carbaldehyde Openeye Name: 4-(benzylamino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 2-(methylthio)-4-[(phenylmethyl)amino]-5-pyrimidinecarboxaldehyde IUPAC Name: 4-(benzylamino)-2-methylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 4-(benzylamino)-2-(methylthio)pyrimidine-5-carbaldehyde Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NCC2=CC=CC=C2)C=O

Isomeric SMILES

CSC1=NC=C(C(=N1)NCC2=CC=CC=C2)C=O

InChI

InChI=1S/C13H13N3OS/c1-18-13-15-8-11(9-17)12(16-13)14-7-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H,14,15,16)