1-[(9-ethylcarbazol-3-yl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[(9-ethylcarbazol-3-yl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one Openeye Name: 1-[(9-ethylcarbazol-3-yl)methyl]-4-(4-pyridylmethyl)-1,4-diazepan-5-one CAS Name: 1-[(9-ethyl-3-carbazolyl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one IUPAC Name: 1-[(9-ethylcarbazol-3-yl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one Traditional Name: 1-[(9-ethylcarbazol-3-yl)methyl]-4-(4-pyridylmethyl)-1,4-diazepan-5-one Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCC(=O)N(CC3)CC4=CC=NC=C4)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCC(=O)N(CC3)CC4=CC=NC=C4)C5=CC=CC=C51

InChI

InChI=1S/C26H28N4O/c1-2-30-24-6-4-3-5-22(24)23-17-21(7-8-25(23)30)18-28-14-11-26(31)29(16-15-28)19-20-9-12-27-13-10-20/h3-10,12-13,17H,2,11,14-16,18-19H2,1H3