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

Systemtic Name: 1-(2-methylpropyl)-N-[1-methyl-2-[(3-propylimidazol-4-yl)methylsulfinyl]benzimidazol-5-yl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 1-isobutyl-N-[1-methyl-2-[(3-propylimidazol-4-yl)methylsulfinyl]benzimidazol-5-yl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 1-(2-methylpropyl)-N-[1-methyl-2-[(3-propyl-4-imidazolyl)methylsulfinyl]-5-benzimidazolyl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 1-(2-methylpropyl)-N-[1-methyl-2-[(3-propylimidazol-4-yl)methylsulfinyl]benzimidazol-5-yl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 1-isobutyl-N-[1-methyl-2-[(3-propylimidazol-4-yl)methylsulfinyl]benzimidazol-5-yl]-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C36H40N6O2S MolecularWeight: 620.8068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC=C1CS(=O)C2=NC3=C(N2C)C=CC(=C3)N(C4=CC=CC=C4)C(=O)C5=CC6=CC=CC=C6N(CC5)CC(C)C

Isomeric SMILES

CCCN1C=NC=C1CS(=O)C2=NC3=C(N2C)C=CC(=C3)N(C4=CC=CC=C4)C(=O)C5=CC6=CC=CC=C6N(CC5)CC(C)C

InChI

InChI=1S/C36H40N6O2S/c1-5-18-41-25-37-22-31(41)24-45(44)36-38-32-21-30(15-16-34(32)39(36)4)42(29-12-7-6-8-13-29)35(43)28-17-19-40(23-26(2)3)33-14-10-9-11-27(33)20-28/h6-16,20-22,25-26H,5,17-19,23-24H2,1-4H3