3-[2-[4-[[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]chromen-2-one

Systemtic Name: 3-[2-[4-[[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]chromen-2-one Openeye Name: 3-[2-[4-[[1-(3-pyridylmethyl)benzimidazol-2-yl]amino]-1-piperidyl]ethyl]chromen-2-one CAS Name: 3-[2-[4-[[1-(3-pyridinylmethyl)-2-benzimidazolyl]amino]-1-piperidinyl]ethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-[4-[[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]chromen-2-one Traditional Name: 3-[2-[4-[[1-(3-pyridylmethyl)benzimidazol-2-yl]amino]piperidino]ethyl]coumarin Formula: C29H29N5O2 MolecularWeight: 479.57286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CN=CC=C4)CCC5=CC6=CC=CC=C6OC5=O

Isomeric SMILES

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CN=CC=C4)CCC5=CC6=CC=CC=C6OC5=O

InChI

InChI=1S/C29H29N5O2/c35-28-23(18-22-7-1-4-10-27(22)36-28)11-15-33-16-12-24(13-17-33)31-29-32-25-8-2-3-9-26(25)34(29)20-21-6-5-14-30-19-21/h1-10,14,18-19,24H,11-13,15-17,20H2,(H,31,32)