N-[1-[[3-(cyclobutylcarbonylamino)phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[1-[[3-(cyclobutylcarbonylamino)phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: N-[1-[[3-(cyclobutanecarbonylamino)phenyl]methylcarbamoyl]-3-methylsulfanyl-propyl]-3-nitro-benzamide CAS Name: N-[1-[[3-[[cyclobutyl(oxo)methyl]amino]phenyl]methylamino]-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: N-[1-[[3-(cyclobutanecarbonylamino)phenyl]methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: N-[1-[[3-(cyclobutanecarbonylamino)benzyl]carbamoyl]-3-(methylthio)propyl]-3-nitro-benzamide Formula: C24H28N4O5S MolecularWeight: 484.56792

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CCC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CCC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H28N4O5S/c1-34-12-11-21(27-23(30)18-8-4-10-20(14-18)28(32)33)24(31)25-15-16-5-2-9-19(13-16)26-22(29)17-6-3-7-17/h2,4-5,8-10,13-14,17,21H,3,6-7,11-12,15H2,1H3,(H,25,31)(H,26,29)(H,27,30)