N-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)ethyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[2-(2,5-dimethyl-1-phenyl-3-pyrrolyl)ethyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: 2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)ethyl-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C24H28N4O5S MolecularWeight: 484.56792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)CCNC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)CCNC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H28N4O5S/c1-18-16-20(19(2)27(18)21-6-4-3-5-7-21)10-11-25-23-9-8-22(28(29)30)17-24(23)34(31,32)26-12-14-33-15-13-26/h3-9,16-17,25H,10-15H2,1-2H3