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

Systemtic Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]thiophene-2-carboxamide Openeye Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]thiophene-2-carboxamide CAS Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]-2-thiophenecarboxamide IUPAC Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]thiophene-2-carboxamide Traditional Name: N-[(3S)-2-ethyl-3-phenyl-3H-1,5-benzodiazepin-4-yl]thiophene-2-carboxamide Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N=C(C1C3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CCC1=NC2=CC=CC=C2N=C([C@H]1C3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3OS/c1-2-16-20(15-9-4-3-5-10-15)21(25-22(26)19-13-8-14-27-19)24-18-12-7-6-11-17(18)23-16/h3-14,20H,2H2,1H3,(H,24,25,26)/t20-/m0/s1