N-(3H-benzimidazol-5-yl)-N-[(3-propylimidazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-(3H-benzimidazol-5-yl)-N-[(3-propylimidazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-(3H-benzimidazol-5-yl)-N-[(3-propylimidazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-(3H-benzimidazol-5-yl)-N-[(3-propyl-4-imidazolyl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-(3H-benzimidazol-5-yl)-N-[(3-propylimidazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-(3H-benzimidazol-5-yl)-N-[(3-propylimidazol-4-yl)methylsulfinyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C25H26N6O2S MolecularWeight: 474.57794

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC=C1CS(=O)N(C2=CC3=C(C=C2)N=CN3)C(=O)C4=CC5=CC=CC=C5NCC4

Isomeric SMILES

CCCN1C=NC=C1CS(=O)N(C2=CC3=C(C=C2)N=CN3)C(=O)C4=CC5=CC=CC=C5NCC4

InChI

InChI=1S/C25H26N6O2S/c1-2-11-30-17-26-14-21(30)15-34(33)31(20-7-8-23-24(13-20)29-16-28-23)25(32)19-9-10-27-22-6-4-3-5-18(22)12-19/h3-8,12-14,16-17,27H,2,9-11,15H2,1H3,(H,28,29)