7-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylamino]-4-methyl-chromen-2-one

Systemtic Name: 7-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylamino]-4-methyl-chromen-2-one Openeye Name: 7-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methylamino]-4-methyl-chromen-2-one CAS Name: 7-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methylamino]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methylamino]-4-methylchromen-2-one Traditional Name: 7-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methylamino]-4-methyl-coumarin Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CNC4=CC5=C(C=C4)C(=CC(=O)O5)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CNC4=CC5=C(C=C4)C(=CC(=O)O5)C

InChI

InChI=1S/C25H28N4O4S/c1-3-29-22-10-8-19(34(31,32)28-11-5-4-6-12-28)15-21(22)27-24(29)16-26-18-7-9-20-17(2)13-25(30)33-23(20)14-18/h7-10,13-15,26H,3-6,11-12,16H2,1-2H3