N-[(3-propylimidazol-4-yl)methyl]-N-(2-sulfanylidene-1H-pyridin-3-yl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(3-propylimidazol-4-yl)methyl]-N-(2-sulfanylidene-1H-pyridin-3-yl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(3-propylimidazol-4-yl)methyl]-N-(2-thioxo-1H-pyridin-3-yl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[(3-propyl-4-imidazolyl)methyl]-N-(2-sulfanylidene-1H-pyridin-3-yl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(3-propylimidazol-4-yl)methyl]-N-(2-sulfanylidene-1H-pyridin-3-yl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[(3-propylimidazol-4-yl)methyl]-N-(2-thioxo-1H-pyridin-3-yl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C23H25N5OS MolecularWeight: 419.5425

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC=C1CN(C2=CC=CNC2=S)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CCCN1C=NC=C1CN(C2=CC=CNC2=S)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C23H25N5OS/c1-2-12-27-16-24-14-19(27)15-28(21-8-5-10-26-22(21)30)23(29)18-9-11-25-20-7-4-3-6-17(20)13-18/h3-8,10,13-14,16,25H,2,9,11-12,15H2,1H3,(H,26,30)