5-chloranyl-2-ethylsulfanyl-N-(furan-2-ylmethyl)-N-(phenylmethyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-(furan-2-ylmethyl)-N-(phenylmethyl)pyrimidine-4-carboxamide Openeye Name: N-benzyl-5-chloro-2-ethylsulfanyl-N-(2-furylmethyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-(2-furanylmethyl)-N-(phenylmethyl)-4-pyrimidinecarboxamide IUPAC Name: N-benzyl-5-chloro-2-ethylsulfanyl-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide Traditional Name: N-benzyl-5-chloro-2-(ethylthio)-N-(2-furfuryl)pyrimidine-4-carboxamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CO3)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CO3)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-2-26-19-21-11-16(20)17(22-19)18(24)23(13-15-9-6-10-25-15)12-14-7-4-3-5-8-14/h3-11H,2,12-13H2,1H3