N-(1,3-benzodioxol-5-yl)-1-[2-phenylethanoyl-[(4-phenyl-1,3-thiazol-2-yl)methyl]amino]cyclopentane-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-phenylethanoyl-[(4-phenyl-1,3-thiazol-2-yl)methyl]amino]cyclopentane-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(2-phenylacetyl)-[(4-phenylthiazol-2-yl)methyl]amino]cyclopentanecarboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(1-oxo-2-phenylethyl)-[(4-phenyl-2-thiazolyl)methyl]amino]-1-cyclopentanecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(2-phenylacetyl)-[(4-phenyl-1,3-thiazol-2-yl)methyl]amino]cyclopentane-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(2-phenylacetyl)-[(4-phenylthiazol-2-yl)methyl]amino]cyclopentanecarboxamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=NC(=CS4)C5=CC=CC=C5)C(=O)CC6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=NC(=CS4)C5=CC=CC=C5)C(=O)CC6=CC=CC=C6

InChI

InChI=1S/C31H29N3O4S/c35-29(17-22-9-3-1-4-10-22)34(19-28-33-25(20-39-28)23-11-5-2-6-12-23)31(15-7-8-16-31)30(36)32-24-13-14-26-27(18-24)38-21-37-26/h1-6,9-14,18,20H,7-8,15-17,19,21H2,(H,32,36)