4-(4-ethylpiperazin-1-yl)-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-ethylpiperazin-1-yl)-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-ethylpiperazin-1-yl)-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-ethyl-1-piperazinyl)-2-(methylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-ethylpiperazin-1-yl)-2-methylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 4-(4-ethylpiperazino)-2-(methylthio)-6-phenyl-pyrimidine-5-carbonitrile Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

InChI

InChI=1S/C18H21N5S/c1-3-22-9-11-23(12-10-22)17-15(13-19)16(20-18(21-17)24-2)14-7-5-4-6-8-14/h4-8H,3,9-12H2,1-2H3