N-[(E)-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methylideneamino]-1H-benzimidazol-2-amine

Systemtic Name: N-[(E)-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methylideneamino]-1H-benzimidazol-2-amine Openeye Name: N-[(E)-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyleneamino]-1H-benzimidazol-2-amine CAS Name: N-[(E)-[2,5-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolyl]methylideneamino]-1H-benzimidazol-2-amine IUPAC Name: N-[(E)-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methylideneamino]-1H-benzimidazol-2-amine Traditional Name: 1H-benzimidazol-2-yl-[(E)-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyleneamino]amine Formula: C24H26N6O3S MolecularWeight: 478.56664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C=NNC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)/C=N/NC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C24H26N6O3S/c1-17-14-19(16-25-28-24-26-22-8-3-4-9-23(22)27-24)18(2)30(17)20-6-5-7-21(15-20)34(31,32)29-10-12-33-13-11-29/h3-9,14-16H,10-13H2,1-2H3,(H2,26,27,28)/b25-16+