(2S)-2-azanyl-N-[1-(3,3-dimethylbutyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide

Systemtic Name: (2S)-2-azanyl-N-[1-(3,3-dimethylbutyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide Openeye Name: (2S)-2-amino-N-[1-(3,3-dimethylbutyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide CAS Name: (2S)-2-amino-N-[1-(3,3-dimethylbutyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: (2S)-2-amino-N-[1-(3,3-dimethylbutyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide Traditional Name: (2S)-2-amino-N-[1-(3,3-dimethylbutyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]propionamide Formula: C24H30N4O2 MolecularWeight: 406.5206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CCC(C)(C)C)N

Isomeric SMILES

C[C@@H](C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CCC(C)(C)C)N

InChI

InChI=1S/C24H30N4O2/c1-16(25)22(29)27-21-23(30)28(15-14-24(2,3)4)19-13-9-8-12-18(19)20(26-21)17-10-6-5-7-11-17/h5-13,16,21H,14-15,25H2,1-4H3,(H,27,29)/t16-,21?/m0/s1