2-[3-(butanoylamino)phenyl]sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide Openeye Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-[4-(3-nitrophenyl)thiazol-2-yl]butanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[[3-(1-oxobutylamino)phenyl]thio]butanamide IUPAC Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 2-[(3-butyramidophenyl)thio]-N-[4-(3-nitrophenyl)thiazol-2-yl]butyramide Formula: C23H24N4O4S2 MolecularWeight: 484.59106

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O4S2/c1-3-7-21(28)24-16-9-6-11-18(13-16)33-20(4-2)22(29)26-23-25-19(14-32-23)15-8-5-10-17(12-15)27(30)31/h5-6,8-14,20H,3-4,7H2,1-2H3,(H,24,28)(H,25,26,29)