tert-butyl N-[2-methyl-4-oxidanylidene-4-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)amino]butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[2-methyl-4-oxidanylidene-4-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)amino]butan-2-yl]carbamate Openeye Name: tert-butyl N-[1,1-dimethyl-3-oxo-3-[(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)amino]propyl]carbamate CAS Name: N-[2-methyl-4-oxo-4-[(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)amino]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-methyl-4-oxo-4-[(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)amino]butan-2-yl]carbamate Traditional Name: N-[3-keto-3-[(4-keto-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)amino]-1,1-dimethyl-propyl]carbamic acid tert-butyl ester Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(C)CC(=O)NC1CSC2=CC=CC=C2NC1=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(C)CC(=O)NC1CSC2=CC=CC=C2NC1=O

InChI

InChI=1S/C19H27N3O4S/c1-18(2,3)26-17(25)22-19(4,5)10-15(23)20-13-11-27-14-9-7-6-8-12(14)21-16(13)24/h6-9,13H,10-11H2,1-5H3,(H,20,23)(H,21,24)(H,22,25)