(3E)-7-chloranyl-1-(2-dimethylaminoethyl)-5-phenyl-3-(pyrrolidin-1-ylmethylidene)-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-7-chloranyl-1-(2-dimethylaminoethyl)-5-phenyl-3-(pyrrolidin-1-ylmethylidene)-1,4-benzodiazepin-2-one Openeye Name: (3E)-7-chloro-1-(2-dimethylaminoethyl)-5-phenyl-3-(pyrrolidin-1-ylmethylene)-1,4-benzodiazepin-2-one CAS Name: (3E)-7-chloro-1-(2-dimethylaminoethyl)-5-phenyl-3-(1-pyrrolidinylmethylidene)-1,4-benzodiazepin-2-one IUPAC Name: (3E)-7-chloro-1-(2-dimethylaminoethyl)-5-phenyl-3-(pyrrolidin-1-ylmethylidene)-1,4-benzodiazepin-2-one Traditional Name: (3E)-7-chloro-1-(2-dimethylaminoethyl)-5-phenyl-3-(pyrrolidinomethylene)-1,4-benzodiazepin-2-one Formula: C24H27ClN4O MolecularWeight: 422.95038

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=C(C=C(C=C2)Cl)C(=NC(=CN3CCCC3)C1=O)C4=CC=CC=C4

Isomeric SMILES

CN(C)CCN1C2=C(C=C(C=C2)Cl)C(=N/C(=C/N3CCCC3)/C1=O)C4=CC=CC=C4

InChI

InChI=1S/C24H27ClN4O/c1-27(2)14-15-29-22-11-10-19(25)16-20(22)23(18-8-4-3-5-9-18)26-21(24(29)30)17-28-12-6-7-13-28/h3-5,8-11,16-17H,6-7,12-15H2,1-2H3/b21-17+