N-[(E)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide

Systemtic Name: N-[(E)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Openeye Name: N-[(E)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-(4-phenylpiperazin-1-yl)propanamide CAS Name: N-[(E)-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-(4-phenyl-1-piperazinyl)propanamide IUPAC Name: N-[(E)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Traditional Name: N-[(E)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-(4-phenylpiperazino)propionamide Formula: C31H30N6O2 MolecularWeight: 518.6089

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NN=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CCC(=O)N/N=C/C2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H30N6O2/c38-30(15-16-35-17-19-36(20-18-35)26-10-3-1-4-11-26)33-32-22-25-23-37(27-12-5-2-6-13-27)34-31(25)29-21-24-9-7-8-14-28(24)39-29/h1-14,21-23H,15-20H2,(H,33,38)/b32-22+