3-[1-phenyl-4-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrazol-3-yl]chromen-2-one

Systemtic Name: 3-[1-phenyl-4-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrazol-3-yl]chromen-2-one Openeye Name: 3-[1-phenyl-4-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrazol-3-yl]chromen-2-one CAS Name: 3-[1-phenyl-4-[[4-(1-pyrrolidinylsulfonyl)phenyl]iminomethyl]-3-pyrazolyl]-1-benzopyran-2-one IUPAC Name: 3-[1-phenyl-4-[(4-pyrrolidin-1-ylsulfonylphenyl)iminomethyl]pyrazol-3-yl]chromen-2-one Traditional Name: 3-[1-phenyl-4-[(4-pyrrolidinosulfonylphenyl)iminomethyl]pyrazol-3-yl]coumarin Formula: C29H24N4O4S MolecularWeight: 524.59026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=CN(N=C3C4=CC5=CC=CC=C5OC4=O)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=CN(N=C3C4=CC5=CC=CC=C5OC4=O)C6=CC=CC=C6

InChI

InChI=1S/C29H24N4O4S/c34-29-26(18-21-8-4-5-11-27(21)37-29)28-22(20-33(31-28)24-9-2-1-3-10-24)19-30-23-12-14-25(15-13-23)38(35,36)32-16-6-7-17-32/h1-5,8-15,18-20H,6-7,16-17H2