N-[[5-(5-chloranylthiophen-2-yl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-4-cyano-benzamide

Systemtic Name: N-[[5-(5-chloranylthiophen-2-yl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-4-cyano-benzamide Openeye Name: N-[[5-(5-chloro-2-thienyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-4-cyano-benzamide CAS Name: N-[[5-(5-chloro-2-thiophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-4-cyanobenzamide IUPAC Name: N-[[5-(5-chlorothiophen-2-yl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-4-cyanobenzamide Traditional Name: N-[[5-(5-chloro-2-thienyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-4-cyano-benzamide Formula: C23H19ClN4OS MolecularWeight: 434.94116

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=C(C2=CC=CC=C21)C3=CC=C(S3)Cl)CNC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN1C(CN=C(C2=CC=CC=C21)C3=CC=C(S3)Cl)CNC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H19ClN4OS/c1-28-17(14-27-23(29)16-8-6-15(12-25)7-9-16)13-26-22(20-10-11-21(24)30-20)18-4-2-3-5-19(18)28/h2-11,17H,13-14H2,1H3,(H,27,29)