7-chloranyl-2-ethyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepine-1,2-diamine

Systemtic Name: 7-chloranyl-2-ethyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepine-1,2-diamine Openeye Name: 7-chloro-2-ethyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepine-1,2-diamine CAS Name: 7-chloro-2-ethyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepine-1,2-diamine IUPAC Name: 7-chloro-2-ethyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepine-1,2-diamine Traditional Name: [1-amino-7-chloro-2-ethyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepin-2-yl]amine Formula: C15H18ClN5 MolecularWeight: 303.78992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN=C(C2=C(N1N)C=CC(=C2)Cl)C3=CC=CN3)N

Isomeric SMILES

CCC1(CN=C(C2=C(N1N)C=CC(=C2)Cl)C3=CC=CN3)N

InChI

InChI=1S/C15H18ClN5/c1-2-15(17)9-20-14(12-4-3-7-19-12)11-8-10(16)5-6-13(11)21(15)18/h3-8,19H,2,9,17-18H2,1H3