N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(phenoxymethyl)furan-2-carboxamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(phenoxymethyl)furan-2-carboxamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(phenoxymethyl)furan-2-carboxamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-3-(phenoxymethyl)-2-furancarboxamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(phenoxymethyl)furan-2-carboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-3-(phenoxymethyl)-2-furamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=C(C=CO3)COC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=C(C=CO3)COC4=CC=CC=C4)C

InChI

InChI=1S/C24H21N3O3S/c1-16-14-17(2)26-24(25-16)31-21-10-8-19(9-11-21)27-23(28)22-18(12-13-29-22)15-30-20-6-4-3-5-7-20/h3-14H,15H2,1-2H3,(H,27,28)