4-(6-fluoranyl-3-oxidanylidene-thiochromeno[4,3-c]pyrazol-2-yl)-N-(1-pyrrolidin-1-ylbutyl)benzamide

Systemtic Name: 4-(6-fluoranyl-3-oxidanylidene-thiochromeno[4,3-c]pyrazol-2-yl)-N-(1-pyrrolidin-1-ylbutyl)benzamide Openeye Name: 4-(6-fluoro-3-oxo-thiochromeno[4,3-c]pyrazol-2-yl)-N-(1-pyrrolidin-1-ylbutyl)benzamide CAS Name: 4-(6-fluoro-3-oxo-2-thiochromeno[4,3-c]pyrazolyl)-N-[1-(1-pyrrolidinyl)butyl]benzamide IUPAC Name: 4-(6-fluoro-3-oxothiochromeno[4,3-c]pyrazol-2-yl)-N-(1-pyrrolidin-1-ylbutyl)benzamide Traditional Name: 4-(6-fluoro-3-keto-thiochromeno[4,3-c]pyrazol-2-yl)-N-(1-pyrrolidinobutyl)benzamide Formula: C25H25FN4O2S MolecularWeight: 464.555003

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC(=O)C1=CC=C(C=C1)N2C(=O)C3=CSC4=C(C3=N2)C=CC=C4F)N5CCCC5

Isomeric SMILES

CCCC(NC(=O)C1=CC=C(C=C1)N2C(=O)C3=CSC4=C(C3=N2)C=CC=C4F)N5CCCC5

InChI

InChI=1S/C25H25FN4O2S/c1-2-6-21(29-13-3-4-14-29)27-24(31)16-9-11-17(12-10-16)30-25(32)19-15-33-23-18(22(19)28-30)7-5-8-20(23)26/h5,7-12,15,21H,2-4,6,13-14H2,1H3,(H,27,31)