4-azanyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[(3-methyl-2-quinoxalinyl)methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[(3-methylquinoxalin-2-yl)methylthio]pyrimidine-5-carbonitrile Formula: C15H12N6S MolecularWeight: 308.36098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C15H12N6S/c1-9-13(20-12-5-3-2-4-11(12)19-9)8-22-15-18-7-10(6-16)14(17)21-15/h2-5,7H,8H2,1H3,(H2,17,18,21)