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4-(2-dimethylaminoethylsulfonyl)-3-(pyridin-3-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile

4-(2-dimethylaminoethylsulfonyl)-3-(pyridin-3-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile

Systemtic Name:4-(2-dimethylaminoethylsulfonyl)-3-(pyridin-3-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile
Openeye Name:4-(2-dimethylaminoethylsulfonyl)-3-(3-pyridylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile
CAS Name:4-(2-dimethylaminoethylsulfonyl)-3-(3-pyridinylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile
IUPAC Name:4-(2-dimethylaminoethylsulfonyl)-3-(pyridin-3-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile
Traditional Name:4-(2-dimethylaminoethylsulfonyl)-3-(3-pyridylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile
Formula: C20H25N5O2S
MolecularWeight: 399.5098
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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCS(=O)(=O)N1CC2=C(C=CC(=C2)C#N)NCC1CC3=CN=CC=C3


Isomeric SMILES

CN(C)CCS(=O)(=O)N1CC2=C(C=CC(=C2)C#N)NCC1CC3=CN=CC=C3


InChI

InChI=1S/C20H25N5O2S/c1-24(2)8-9-28(26,27)25-15-18-10-16(12-21)5-6-20(18)23-14-19(25)11-17-4-3-7-22-13-17/h3-7,10,13,19,23H,8-9,11,14-15H2,1-2H3


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