N-[2-(1-cyanoethylsulfanyl)-5,6-dimethyl-furo[2,3-d]pyrimidin-4-yl]benzamide

Systemtic Name: N-[2-(1-cyanoethylsulfanyl)-5,6-dimethyl-furo[2,3-d]pyrimidin-4-yl]benzamide Openeye Name: N-[2-(1-cyanoethylsulfanyl)-5,6-dimethyl-furo[2,3-d]pyrimidin-4-yl]benzamide CAS Name: N-[2-(1-cyanoethylthio)-5,6-dimethyl-4-furo[2,3-d]pyrimidinyl]benzamide IUPAC Name: N-[2-(1-cyanoethylsulfanyl)-5,6-dimethylfuro[2,3-d]pyrimidin-4-yl]benzamide Traditional Name: N-[2-(1-cyanoethylthio)-5,6-dimethyl-furo[2,3-d]pyrimidin-4-yl]benzamide Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=NC(=NC(=C12)NC(=O)C3=CC=CC=C3)SC(C)C#N)C

Isomeric SMILES

CC1=C(OC2=NC(=NC(=C12)NC(=O)C3=CC=CC=C3)SC(C)C#N)C

InChI

InChI=1S/C18H16N4O2S/c1-10(9-19)25-18-21-15(14-11(2)12(3)24-17(14)22-18)20-16(23)13-7-5-4-6-8-13/h4-8,10H,1-3H3,(H,20,21,22,23)