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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)carbamoyl-propan-2-yl-amino]-N-[(3-methylthiophen-2-yl)methyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[isopropyl(p-tolylcarbamoyl)amino]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(4-methylanilino)-oxomethyl]-propan-2-ylamino]-N-[(3-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)carbamoyl-propan-2-ylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[isopropyl(p-tolylcarbamoyl)amino]-N-[(3-methyl-2-thienyl)methyl]-N-piperonyl-acetamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=C(C=CS4)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=C(C=CS4)C)C(C)C

InChI

InChI=1S/C27H31N3O4S/c1-18(2)30(27(32)28-22-8-5-19(3)6-9-22)16-26(31)29(15-25-20(4)11-12-35-25)14-21-7-10-23-24(13-21)34-17-33-23/h5-13,18H,14-17H2,1-4H3,(H,28,32)