N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(E)-(1,3-diphenyl-4-pyrazolyl)methylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-3-pyrrolidinosulfonyl-benzamide Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N/N=C/C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N5O3S/c33-27(22-12-9-15-25(18-22)36(34,35)31-16-7-8-17-31)29-28-19-23-20-32(24-13-5-2-6-14-24)30-26(23)21-10-3-1-4-11-21/h1-6,9-15,18-20H,7-8,16-17H2,(H,29,33)/b28-19+