N-[(2R)-1-[[4-(cyanomethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2R)-1-[[4-(cyanomethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1R)-1-[[4-(cyanomethyl)phenyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[(2R)-1-[4-(cyanomethyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2R)-1-[4-(cyanomethyl)anilino]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1R)-1-[[4-(cyanomethyl)phenyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)CC#N)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@H](C(=O)NC1=CC=C(C=C1)CC#N)NC(=O)C2=CC=CS2

InChI

InChI=1S/C18H19N3O2S/c1-12(2)16(21-17(22)15-4-3-11-24-15)18(23)20-14-7-5-13(6-8-14)9-10-19/h3-8,11-12,16H,9H2,1-2H3,(H,20,23)(H,21,22)/t16-/m1/s1