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

Systemtic Name: (2S)-2-azanyl-N-[2-oxidanylidene-1-(oxolan-2-ylmethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide Openeye Name: (2S)-2-amino-N-[2-oxo-5-phenyl-1-(tetrahydrofuran-2-ylmethyl)-3H-1,4-benzodiazepin-3-yl]propanamide CAS Name: (2S)-2-amino-N-[2-oxo-1-(2-oxolanylmethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: (2S)-2-amino-N-[2-oxo-1-(oxolan-2-ylmethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide Traditional Name: (2S)-2-amino-N-[2-keto-5-phenyl-1-(tetrahydrofurfuryl)-3H-1,4-benzodiazepin-3-yl]propionamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CC4CCCO4)N

Isomeric SMILES

C[C@@H](C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CC4CCCO4)N

InChI

InChI=1S/C23H26N4O3/c1-15(24)22(28)26-21-23(29)27(14-17-10-7-13-30-17)19-12-6-5-11-18(19)20(25-21)16-8-3-2-4-9-16/h2-6,8-9,11-12,15,17,21H,7,10,13-14,24H2,1H3,(H,26,28)/t15-,17?,21?/m0/s1