N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-cyclohexyl-N-[2-[(4-fluorobenzyl)-(2-thenyl)amino]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C28H30FN3O4S MolecularWeight: 523.618903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C28H30FN3O4S/c1-20-9-12-22(16-26(20)32(35)36)28(34)31(24-6-3-2-4-7-24)19-27(33)30(18-25-8-5-15-37-25)17-21-10-13-23(29)14-11-21/h5,8-16,24H,2-4,6-7,17-19H2,1H3