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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C(C)N)C3=CC=CC=C3

Isomeric SMILES

CCC(CC)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)[C@H](C)N)C3=CC=CC=C3

InChI

InChI=1S/C24H30N4O2/c1-4-17(5-2)15-28-20-14-10-9-13-19(20)21(18-11-7-6-8-12-18)26-22(24(28)30)27-23(29)16(3)25/h6-14,16-17,22H,4-5,15,25H2,1-3H3,(H,27,29)/t16-,22?/m0/s1