N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-methylfuran-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-yl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-methylfuran-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-yl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[isopropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]-N-[(5-methyl-2-furyl)methyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-methyl-2-furanyl)methyl]-2-[[[4-(methylthio)anilino]-oxomethyl]-propan-2-ylamino]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-methylfuran-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-ylamino]acetamide Traditional Name: 2-[isopropyl-[[4-(methylthio)phenyl]carbamoyl]amino]-N-[(5-methyl-2-furyl)methyl]-N-piperonyl-acetamide Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(C(C)C)C(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(C(C)C)C(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C27H31N3O5S/c1-18(2)30(27(32)28-21-7-10-23(36-4)11-8-21)16-26(31)29(15-22-9-5-19(3)35-22)14-20-6-12-24-25(13-20)34-17-33-24/h5-13,18H,14-17H2,1-4H3,(H,28,32)