7-chloranyl-1-(2-chloroethyl)-2-(chloromethyl)-5-thiophen-3-yl-2,3-dihydro-1,4-benzodiazepine

Systemtic Name: 7-chloranyl-1-(2-chloroethyl)-2-(chloromethyl)-5-thiophen-3-yl-2,3-dihydro-1,4-benzodiazepine Openeye Name: 7-chloro-1-(2-chloroethyl)-2-(chloromethyl)-5-(3-thienyl)-2,3-dihydro-1,4-benzodiazepine CAS Name: 7-chloro-1-(2-chloroethyl)-2-(chloromethyl)-5-(3-thiophenyl)-2,3-dihydro-1,4-benzodiazepine IUPAC Name: 7-chloro-1-(2-chloroethyl)-2-(chloromethyl)-5-thiophen-3-yl-2,3-dihydro-1,4-benzodiazepine Traditional Name: 7-chloro-1-(2-chloroethyl)-2-(chloromethyl)-5-(3-thienyl)-2,3-dihydro-1,4-benzodiazepine Formula: C16H15Cl3N2S MolecularWeight: 373.7277

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CSC=C3)CCCl)CCl

Isomeric SMILES

C1C(N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CSC=C3)CCCl)CCl

InChI

InChI=1S/C16H15Cl3N2S/c17-4-5-21-13(8-18)9-20-16(11-3-6-22-10-11)14-7-12(19)1-2-15(14)21/h1-3,6-7,10,13H,4-5,8-9H2