5-nitro-N-propan-2-yl-2-[2-(propan-2-ylcarbamoyl)phenyl]sulfanyl-benzamide

Systemtic Name: 5-nitro-N-propan-2-yl-2-[2-(propan-2-ylcarbamoyl)phenyl]sulfanyl-benzamide Openeye Name: N-isopropyl-2-[2-(isopropylcarbamoyl)phenyl]sulfanyl-5-nitro-benzamide CAS Name: 5-nitro-2-[[2-[oxo-(propan-2-ylamino)methyl]phenyl]thio]-N-propan-2-ylbenzamide IUPAC Name: 5-nitro-N-propan-2-yl-2-[2-(propan-2-ylcarbamoyl)phenyl]sulfanylbenzamide Traditional Name: N-isopropyl-2-[[2-(isopropylcarbamoyl)phenyl]thio]-5-nitro-benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(C)C

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(C)C

InChI

InChI=1S/C20H23N3O4S/c1-12(2)21-19(24)15-7-5-6-8-17(15)28-18-10-9-14(23(26)27)11-16(18)20(25)22-13(3)4/h5-13H,1-4H3,(H,21,24)(H,22,25)