N-phenyl-N-[(2-propyl-1,2,3-triazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-phenyl-N-[(2-propyl-1,2,3-triazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-phenyl-N-[(2-propyltriazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-phenyl-N-[(2-propyl-4-triazolyl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-phenyl-N-[(2-propyltriazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-phenyl-N-[(2-propyltriazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1N=CC(=N1)CS(=O)N(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CCCN1N=CC(=N1)CS(=O)N(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C23H25N5O2S/c1-2-14-27-25-16-20(26-27)17-31(30)28(21-9-4-3-5-10-21)23(29)19-12-13-24-22-11-7-6-8-18(22)15-19/h3-11,15-16,24H,2,12-14,17H2,1H3