7-chloranyl-1-(2-diethylaminoethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one hydrochloride

Systemtic Name: 7-chloranyl-1-(2-diethylaminoethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one hydrochloride Openeye Name: 7-chloro-1-(2-diethylaminoethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one hydrochloride CAS Name: 7-chloro-1-(2-diethylaminoethyl)-5-(2-pyridinyl)-3H-1,4-benzodiazepin-2-one hydrochloride IUPAC Name: 7-chloro-1-(2-diethylaminoethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one hydrochloride Traditional Name: 7-chloro-1-(2-diethylaminoethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one hydrochloride Formula: C20H24Cl2N4O MolecularWeight: 407.33676

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=N3.Cl

Isomeric SMILES

CCN(CC)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=N3.Cl

InChI

InChI=1S/C20H23ClN4O.ClH/c1-3-24(4-2)11-12-25-18-9-8-15(21)13-16(18)20(23-14-19(25)26)17-7-5-6-10-22-17;/h5-10,13H,3-4,11-12,14H2,1-2H3;1H