N-[(3-propylimidazol-4-yl)methylsulfinyl]-N-pyridazin-3-yl-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(3-propylimidazol-4-yl)methylsulfinyl]-N-pyridazin-3-yl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(3-propylimidazol-4-yl)methylsulfinyl]-N-pyridazin-3-yl-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[(3-propyl-4-imidazolyl)methylsulfinyl]-N-(3-pyridazinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(3-propylimidazol-4-yl)methylsulfinyl]-N-pyridazin-3-yl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[(3-propylimidazol-4-yl)methylsulfinyl]-N-pyridazin-3-yl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C22H24N6O2S MolecularWeight: 436.52996

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC=C1CS(=O)N(C2=NN=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CCCN1C=NC=C1CS(=O)N(C2=NN=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C22H24N6O2S/c1-2-12-27-16-23-14-19(27)15-31(30)28(21-8-5-10-25-26-21)22(29)18-9-11-24-20-7-4-3-6-17(20)13-18/h3-8,10,13-14,16,24H,2,9,11-12,15H2,1H3