N-[(2S)-1-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[[5-(4-chlorophenyl)-2-furyl]methylcarbamoyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[[5-(4-chlorophenyl)-2-furanyl]methylamino]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[[5-(4-chlorophenyl)-2-furyl]methylcarbamoyl]-2-methyl-propyl]-2-furamide Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(O1)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(O1)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H21ClN2O4/c1-13(2)19(24-20(25)18-4-3-11-27-18)21(26)23-12-16-9-10-17(28-16)14-5-7-15(22)8-6-14/h3-11,13,19H,12H2,1-2H3,(H,23,26)(H,24,25)/t19-/m0/s1