tert-butyl N-[(2S)-1-[(1-methyl-2-oxidanylidene-4-propan-2-yl-3H-1,5-benzodiazepin-3-yl)amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(1-methyl-2-oxidanylidene-4-propan-2-yl-3H-1,5-benzodiazepin-3-yl)amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-[(4-isopropyl-1-methyl-2-oxo-3H-1,5-benzodiazepin-3-yl)amino]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[(1-methyl-2-oxo-4-propan-2-yl-3H-1,5-benzodiazepin-3-yl)amino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[(1-methyl-2-oxo-4-propan-2-yl-3H-1,5-benzodiazepin-3-yl)amino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[(4-isopropyl-2-keto-1-methyl-3H-1,5-benzodiazepin-3-yl)amino]-2-keto-1-methyl-ethyl]carbamic acid tert-butyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2N(C(=O)C1NC(=O)C(C)NC(=O)OC(C)(C)C)C

Isomeric SMILES

C[C@@H](C(=O)NC1C(=NC2=CC=CC=C2N(C1=O)C)C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N4O4/c1-12(2)16-17(19(27)25(7)15-11-9-8-10-14(15)23-16)24-18(26)13(3)22-20(28)29-21(4,5)6/h8-13,17H,1-7H3,(H,22,28)(H,24,26)/t13-,17?/m0/s1