N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]-3-piperidinosulfonyl-benzamide Formula: C27H32N6O3S MolecularWeight: 520.64638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)N4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)N4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H32N6O3S/c1-21-25(27(31-15-8-9-16-31)33(30-21)23-12-4-2-5-13-23)20-28-29-26(34)22-11-10-14-24(19-22)37(35,36)32-17-6-3-7-18-32/h2,4-5,10-14,19-20H,3,6-9,15-18H2,1H3,(H,29,34)/b28-20+