1-(2-ethylsulfanyl-6-propyl-pyrimidin-4-yl)benzimidazole

Systemtic Name: 1-(2-ethylsulfanyl-6-propyl-pyrimidin-4-yl)benzimidazole Openeye Name: 1-(2-ethylsulfanyl-6-propyl-pyrimidin-4-yl)benzimidazole CAS Name: 1-[2-(ethylthio)-6-propyl-4-pyrimidinyl]benzimidazole IUPAC Name: 1-(2-ethylsulfanyl-6-propylpyrimidin-4-yl)benzimidazole Traditional Name: 1-[2-(ethylthio)-6-propyl-pyrimidin-4-yl]benzimidazole Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SCC)N2C=NC3=CC=CC=C32

Isomeric SMILES

CCCC1=CC(=NC(=N1)SCC)N2C=NC3=CC=CC=C32

InChI

InChI=1S/C16H18N4S/c1-3-7-12-10-15(19-16(18-12)21-4-2)20-11-17-13-8-5-6-9-14(13)20/h5-6,8-11H,3-4,7H2,1-2H3