(NE)-N-(1,3,3-trimethyl-5-phenyl-1,4-benzodiazepin-2-ylidene)methanesulfonamide

Systemtic Name: (NE)-N-(1,3,3-trimethyl-5-phenyl-1,4-benzodiazepin-2-ylidene)methanesulfonamide Openeye Name: (NE)-N-(1,3,3-trimethyl-5-phenyl-1,4-benzodiazepin-2-ylidene)methanesulfonamide CAS Name: (NE)-N-(1,3,3-trimethyl-5-phenyl-1,4-benzodiazepin-2-ylidene)methanesulfonamide IUPAC Name: (NE)-N-(1,3,3-trimethyl-5-phenyl-1,4-benzodiazepin-2-ylidene)methanesulfonamide Traditional Name: (NE)-N-(1,3,3-trimethyl-5-phenyl-1,4-benzodiazepin-2-ylidene)methanesulfonamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NS(=O)(=O)C)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1(/C(=N\S(=O)(=O)C)/N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)C

InChI

InChI=1S/C19H21N3O2S/c1-19(2)18(21-25(4,23)24)22(3)16-13-9-8-12-15(16)17(20-19)14-10-6-5-7-11-14/h5-13H,1-4H3/b21-18+