4-[2-[(4-chloranylpyridin-3-yl)amino]pyrimidin-4-yl]-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile

Systemtic Name: 4-[2-[(4-chloranylpyridin-3-yl)amino]pyrimidin-4-yl]-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile Openeye Name: 4-[2-[(4-chloro-3-pyridyl)amino]pyrimidin-4-yl]-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile CAS Name: 4-[2-[(4-chloro-3-pyridinyl)amino]-4-pyrimidinyl]-3-methyl-5-(methylthio)-2-thiophenecarbonitrile IUPAC Name: 4-[2-[(4-chloropyridin-3-yl)amino]pyrimidin-4-yl]-3-methyl-5-methylsulfanylthiophene-2-carbonitrile Traditional Name: 4-[2-[(4-chloro-3-pyridyl)amino]pyrimidin-4-yl]-3-methyl-5-(methylthio)thiophene-2-carbonitrile Formula: C16H12ClN5S2 MolecularWeight: 373.88298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C2=NC(=NC=C2)NC3=C(C=CN=C3)Cl)SC)C#N

Isomeric SMILES

CC1=C(SC(=C1C2=NC(=NC=C2)NC3=C(C=CN=C3)Cl)SC)C#N

InChI

InChI=1S/C16H12ClN5S2/c1-9-13(7-18)24-15(23-2)14(9)11-4-6-20-16(21-11)22-12-8-19-5-3-10(12)17/h3-6,8H,1-2H3,(H,20,21,22)