4-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one

Systemtic Name: 4-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Openeye Name: 4-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one CAS Name: 4-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl]-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-piperazinone IUPAC Name: 4-[(6-chloro-7-methyl-2-oxochromen-4-yl)methyl]-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one Traditional Name: 4-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Formula: C26H25ClN4O3 MolecularWeight: 476.9547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCNC(=O)C3C4=C(N(N=C4C)C5=CC=CC=C5)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCNC(=O)C3C4=C(N(N=C4C)C5=CC=CC=C5)C)Cl

InChI

InChI=1S/C26H25ClN4O3/c1-15-11-22-20(13-21(15)27)18(12-23(32)34-22)14-30-10-9-28-26(33)25(30)24-16(2)29-31(17(24)3)19-7-5-4-6-8-19/h4-8,11-13,25H,9-10,14H2,1-3H3,(H,28,33)