N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide

Systemtic Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Openeye Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]-3-(4-phenylpiperazin-1-yl)propanamide CAS Name: N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]-3-(4-phenyl-1-piperazinyl)propanamide IUPAC Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Traditional Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]-3-(4-phenylpiperazino)propionamide Formula: C28H35N7O MolecularWeight: 485.6238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)CCN2CCN(CC2)C3=CC=CC=C3)N4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)CCN2CCN(CC2)C3=CC=CC=C3)N4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H35N7O/c1-23-26(28(34-15-8-9-16-34)35(31-23)25-12-6-3-7-13-25)22-29-30-27(36)14-17-32-18-20-33(21-19-32)24-10-4-2-5-11-24/h2-7,10-13,22H,8-9,14-21H2,1H3,(H,30,36)/b29-22+