2-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]ethanoylamino]-N-[(1S)-1-phenylethyl]benzamide

Systemtic Name: 2-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]ethanoylamino]-N-[(1S)-1-phenylethyl]benzamide Openeye Name: 2-[[2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide CAS Name: 2-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-[(1S)-1-phenylethyl]benzamide IUPAC Name: 2-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide Traditional Name: 2-[[2-(3-chloro-N-mesyl-4-methoxy-anilino)acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide Formula: C25H26ClN3O5S MolecularWeight: 516.00904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CN(C3=CC(=C(C=C3)OC)Cl)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CN(C3=CC(=C(C=C3)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C25H26ClN3O5S/c1-17(18-9-5-4-6-10-18)27-25(31)20-11-7-8-12-22(20)28-24(30)16-29(35(3,32)33)19-13-14-23(34-2)21(26)15-19/h4-15,17H,16H2,1-3H3,(H,27,31)(H,28,30)/t17-/m0/s1