2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-(2-thiophen-2-ylethanoylamino)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-(2-thiophen-2-ylethanoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(tetrahydrofuran-2-ylmethyl)-5-[[2-(2-thienyl)acetyl]amino]benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-oxolanylmethyl)-5-[(1-oxo-2-thiophen-2-ylethyl)amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[(2-thiophen-2-ylacetyl)amino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(tetrahydrofurfuryl)-5-[[2-(2-thienyl)acetyl]amino]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CS3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CS3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H29N3O3S/c31-26(16-23-8-4-14-34-23)29-21-9-10-25(30-12-11-19-5-1-2-6-20(19)18-30)24(15-21)27(32)28-17-22-7-3-13-33-22/h1-2,4-6,8-10,14-15,22H,3,7,11-13,16-18H2,(H,28,32)(H,29,31)