N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]cyclopropanecarboxamide

Systemtic Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]cyclopropanecarboxamide Openeye Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]cyclopropanecarboxamide CAS Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]cyclopropanecarboxamide IUPAC Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]cyclopropanecarboxamide Traditional Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]cyclopropanecarboxamide Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N=C(C1C3=CC=CC=C3)NC(=O)C4CC4

Isomeric SMILES

CCC1=NC2=CC=CC=C2N=C([C@H]1C3=CC=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C21H21N3O/c1-2-16-19(14-8-4-3-5-9-14)20(24-21(25)15-12-13-15)23-18-11-7-6-10-17(18)22-16/h3-11,15,19H,2,12-13H2,1H3,(H,23,24,25)/t19-/m0/s1