N-[(2R)-1-[[4-(cyanomethyl)phenyl]amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2R)-1-[[4-(cyanomethyl)phenyl]amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1R)-1-[[4-(cyanomethyl)phenyl]carbamoyl]-3-methylsulfonyl-propyl]benzamide CAS Name: N-[(2R)-1-[4-(cyanomethyl)anilino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2R)-1-[4-(cyanomethyl)anilino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1R)-1-[[4-(cyanomethyl)phenyl]carbamoyl]-3-mesyl-propyl]benzamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC=C(C=C1)CC#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)CC[C@H](C(=O)NC1=CC=C(C=C1)CC#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21N3O4S/c1-28(26,27)14-12-18(23-19(24)16-5-3-2-4-6-16)20(25)22-17-9-7-15(8-10-17)11-13-21/h2-10,18H,11-12,14H2,1H3,(H,22,25)(H,23,24)/t18-/m1/s1