2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-cyclohexyl-amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-cyclohexyl-amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-chloro-3-nitro-phenyl)sulfonyl-cyclohexyl-amino]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonyl-cyclohexylamino]-N-[(5-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-chloro-3-nitrophenyl)sulfonyl-cyclohexylamino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[(4-chloro-3-nitro-phenyl)sulfonyl-cyclohexyl-amino]-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C27H30ClN3O5S2 MolecularWeight: 576.1272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(C3CCCCC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(C3CCCCC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H30ClN3O5S2/c1-20-12-13-23(37-20)18-29(17-21-8-4-2-5-9-21)27(32)19-30(22-10-6-3-7-11-22)38(35,36)24-14-15-25(28)26(16-24)31(33)34/h2,4-5,8-9,12-16,22H,3,6-7,10-11,17-19H2,1H3