2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-nitro-anilino)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide Formula: C24H25N3O6S2 MolecularWeight: 515.6018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)CN(C3=C(C=CC(=C3)[N+](=O)[O-])OC)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)CN(C3=C(C=CC(=C3)[N+](=O)[O-])OC)S(=O)(=O)C

InChI

InChI=1S/C24H25N3O6S2/c1-17-13-18(16-34-20-7-5-4-6-8-20)9-11-21(17)25-24(28)15-26(35(3,31)32)22-14-19(27(29)30)10-12-23(22)33-2/h4-14H,15-16H2,1-3H3,(H,25,28)