N-[(E)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylideneamino]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylideneamino]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methyleneamino]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[(E)-(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylideneamino]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(2,5-dimethyl-1-phenylpyrrol-3-yl)methylideneamino]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methyleneamino]-4-piperidinosulfonyl-benzamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C=NNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)/C=N/NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H28N4O3S/c1-19-17-22(20(2)29(19)23-9-5-3-6-10-23)18-26-27-25(30)21-11-13-24(14-12-21)33(31,32)28-15-7-4-8-16-28/h3,5-6,9-14,17-18H,4,7-8,15-16H2,1-2H3,(H,27,30)/b26-18+