[6-(2-dimethylaminoethylamino)pyridin-3-yl]-(4-phenylazepan-1-yl)methanone

Systemtic Name: [6-(2-dimethylaminoethylamino)pyridin-3-yl]-(4-phenylazepan-1-yl)methanone Openeye Name: [6-(2-dimethylaminoethylamino)-3-pyridyl]-(4-phenylazepan-1-yl)methanone CAS Name: [6-(2-dimethylaminoethylamino)-3-pyridinyl]-(4-phenyl-1-azepanyl)methanone IUPAC Name: [6-(2-dimethylaminoethylamino)pyridin-3-yl]-(4-phenylazepan-1-yl)methanone Traditional Name: [6-(2-dimethylaminoethylamino)-3-pyridyl]-(4-phenylazepan-1-yl)methanone Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=NC=C(C=C1)C(=O)N2CCCC(CC2)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCNC1=NC=C(C=C1)C(=O)N2CCCC(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H30N4O/c1-25(2)16-13-23-21-11-10-20(17-24-21)22(27)26-14-6-9-19(12-15-26)18-7-4-3-5-8-18/h3-5,7-8,10-11,17,19H,6,9,12-16H2,1-2H3,(H,23,24)