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

Systemtic Name: N-[(E)-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Openeye Name: N-[(E)-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-(4-phenylpiperazin-1-yl)propanamide CAS Name: N-[(E)-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-(4-phenyl-1-piperazinyl)propanamide IUPAC Name: N-[(E)-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Traditional Name: N-[(E)-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-(4-phenylpiperazino)propionamide Formula: C32H30N6O3 MolecularWeight: 546.619

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NN=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CCC(=O)N/N=C/C2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H30N6O3/c39-30(15-16-36-17-19-37(20-18-36)26-10-3-1-4-11-26)34-33-22-25-23-38(27-12-5-2-6-13-27)35-31(25)28-21-24-9-7-8-14-29(24)41-32(28)40/h1-14,21-23H,15-20H2,(H,34,39)/b33-22+