N-(6-butylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)-3-fluoranyl-benzamide

Systemtic Name: N-(6-butylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)-3-fluoranyl-benzamide Openeye Name: N-(6-butylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)-3-fluoro-benzamide CAS Name: N-(6-butylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)-3-fluorobenzamide IUPAC Name: N-(6-butylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)-3-fluorobenzamide Traditional Name: N-(6-butylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)-3-fluoro-benzamide Formula: C18H21FN4O3S MolecularWeight: 392.447743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC2=NC(=NC=C2C1)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCCS(=O)(=O)N1CCC2=NC(=NC=C2C1)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H21FN4O3S/c1-2-3-9-27(25,26)23-8-7-16-14(12-23)11-20-18(21-16)22-17(24)13-5-4-6-15(19)10-13/h4-6,10-11H,2-3,7-9,12H2,1H3,(H,20,21,22,24)