N-[[methyl(oxan-4-yl)amino]methyl]-N-phenyl-1-(thiophen-3-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: N-[[methyl(oxan-4-yl)amino]methyl]-N-phenyl-1-(thiophen-3-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: N-[[methyl(tetrahydropyran-4-yl)amino]methyl]-N-phenyl-1-(3-thienylmethyl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: N-[[methyl(4-oxanyl)amino]methyl]-N-phenyl-1-(3-thiophenylmethyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: N-[[methyl(oxan-4-yl)amino]methyl]-N-phenyl-1-(thiophen-3-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: N-[[methyl(tetrahydropyran-4-yl)amino]methyl]-N-phenyl-1-(3-thenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C29H33N3O2S MolecularWeight: 487.65622

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN(C1=CC=CC=C1)C(=O)C2=CC3=CC=CC=C3N(CC2)CC4=CSC=C4)C5CCOCC5

Isomeric SMILES

CN(CN(C1=CC=CC=C1)C(=O)C2=CC3=CC=CC=C3N(CC2)CC4=CSC=C4)C5CCOCC5

InChI

InChI=1S/C29H33N3O2S/c1-30(26-12-16-34-17-13-26)22-32(27-8-3-2-4-9-27)29(33)25-11-15-31(20-23-14-18-35-21-23)28-10-6-5-7-24(28)19-25/h2-10,14,18-19,21,26H,11-13,15-17,20,22H2,1H3