N-[3-[2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoylamino]phenyl]propanamide

Systemtic Name: N-[3-[2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoylamino]phenyl]propanamide Openeye Name: N-[3-[[2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetyl]amino]phenyl]propanamide CAS Name: N-[3-[[2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: N-[3-[[2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]acetyl]amino]phenyl]propanamide Traditional Name: N-[3-[[2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetyl]amino]phenyl]propionamide Formula: C16H18ClN3O4S2 MolecularWeight: 415.91482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=O)CN(C)S(=O)(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=O)CN(C)S(=O)(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C16H18ClN3O4S2/c1-3-14(21)18-11-5-4-6-12(9-11)19-15(22)10-20(2)26(23,24)16-8-7-13(17)25-16/h4-9H,3,10H2,1-2H3,(H,18,21)(H,19,22)