N-(2-azanylethyl)-1-(3-cyclopentylpropanoyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-cyclopentylpropanoyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-cyclopentylpropanoyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-(3-cyclopentyl-1-oxopropyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-cyclopentylpropanoyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3-cyclopentylpropanoyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide Formula: C21H31FN4O4S MolecularWeight: 454.558643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H31FN4O4S/c22-17-7-9-18(10-8-17)31(29,30)26-15-3-14-25(21(26)20(28)24-13-12-23)19(27)11-6-16-4-1-2-5-16/h7-10,16,21H,1-6,11-15,23H2,(H,24,28)