tert-butyl N-(5-methylsulfonyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-3-yl)carbamate

Systemtic Name: tert-butyl N-(5-methylsulfonyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-3-yl)carbamate Openeye Name: tert-butyl N-(5-methylsulfonyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-3-yl)carbamate CAS Name: N-(5-methylsulfonyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-3-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(5-methylsulfonyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-3-yl)carbamate Traditional Name: N-(2-keto-5-mesyl-3,4-dihydro-1H-1,5-benzodiazepin-3-yl)carbamic acid tert-butyl ester Formula: C15H21N3O5S MolecularWeight: 355.40934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CN(C2=CC=CC=C2NC1=O)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)NC1CN(C2=CC=CC=C2NC1=O)S(=O)(=O)C

InChI

InChI=1S/C15H21N3O5S/c1-15(2,3)23-14(20)17-11-9-18(24(4,21)22)12-8-6-5-7-10(12)16-13(11)19/h5-8,11H,9H2,1-4H3,(H,16,19)(H,17,20)