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

Systemtic Name: N-(2-azanylethyl)-1-(4-fluorophenyl)sulfonyl-3-(2-thiophen-2-ylethanoyl)-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(4-fluorophenyl)sulfonyl-3-[2-(2-thienyl)acetyl]hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-(4-fluorophenyl)sulfonyl-3-(1-oxo-2-thiophen-2-ylethyl)-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-fluorophenyl)sulfonyl-3-(2-thiophen-2-ylacetyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(4-fluorophenyl)sulfonyl-3-[2-(2-thienyl)acetyl]hexahydropyrimidine-2-carboxamide Formula: C19H23FN4O4S2 MolecularWeight: 454.538723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCN)C(=O)CC3=CC=CS3

Isomeric SMILES

C1CN(C(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCN)C(=O)CC3=CC=CS3

InChI

InChI=1S/C19H23FN4O4S2/c20-14-4-6-16(7-5-14)30(27,28)24-11-2-10-23(19(24)18(26)22-9-8-21)17(25)13-15-3-1-12-29-15/h1,3-7,12,19H,2,8-11,13,21H2,(H,22,26)