N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-2-thiophen-2-yl-ethanamide Openeye Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]-2-(2-thienyl)acetamide CAS Name: N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]-2-thiophen-2-ylacetamide IUPAC Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]-2-thiophen-2-ylacetamide Traditional Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]-2-(2-thienyl)acetamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)CC2=CC=CS2)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)CC2=CC=CS2)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5OS/c1-16-19(15-22-23-20(27)14-18-10-7-13-28-18)21(25-11-5-6-12-25)26(24-16)17-8-3-2-4-9-17/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,23,27)/b22-15+