4-azanyl-N-[(E)-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methylideneamino]benzamide

Systemtic Name: 4-azanyl-N-[(E)-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methylideneamino]benzamide Openeye Name: 4-amino-N-[(E)-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyleneamino]benzamide CAS Name: 4-amino-N-[(E)-[2,5-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolyl]methylideneamino]benzamide IUPAC Name: 4-amino-N-[(E)-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methylideneamino]benzamide Traditional Name: 4-amino-N-[(E)-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyleneamino]benzamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C=NNC(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)/C=N/NC(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C24H27N5O4S/c1-17-14-20(16-26-27-24(30)19-6-8-21(25)9-7-19)18(2)29(17)22-4-3-5-23(15-22)34(31,32)28-10-12-33-13-11-28/h3-9,14-16H,10-13,25H2,1-2H3,(H,27,30)/b26-16+