2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-cyclohexyl-2-(5-methylfuran-2-yl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-cyclohexyl-2-(5-methylfuran-2-yl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)acetyl]amino]-N-cyclohexyl-2-(5-methyl-2-furyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(1-benzotriazolyl)-1-oxoethyl]amino]-N-cyclohexyl-2-(5-methyl-2-furanyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)acetyl]amino]-N-cyclohexyl-2-(5-methylfuran-2-yl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-piperonyl-amino]-N-cyclohexyl-2-(5-methyl-2-furyl)acetamide Formula: C29H31N5O5 MolecularWeight: 529.58694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C(=O)NC2CCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

CC1=CC=C(O1)C(C(=O)NC2CCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C29H31N5O5/c1-19-11-13-25(39-19)28(29(36)30-21-7-3-2-4-8-21)33(16-20-12-14-24-26(15-20)38-18-37-24)27(35)17-34-23-10-6-5-9-22(23)31-32-34/h5-6,9-15,21,28H,2-4,7-8,16-18H2,1H3,(H,30,36)