N-[4-[[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[[4-[methyl(thiophen-2-ylsulfonyl)amino]-1-oxobutyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NCC1=CC=C(C=C1)NC(=O)C2CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)NCC1=CC=C(C=C1)NC(=O)C2CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H25N3O4S2/c1-23(29(26,27)19-5-3-13-28-19)12-2-4-18(24)21-14-15-6-10-17(11-7-15)22-20(25)16-8-9-16/h3,5-7,10-11,13,16H,2,4,8-9,12,14H2,1H3,(H,21,24)(H,22,25)