N-(1,3-benzodioxol-5-ylmethyl)-2-[(phenylmethyl)carbamoyl-propan-2-yl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(phenylmethyl)carbamoyl-propan-2-yl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[benzylcarbamoyl(isopropyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[oxo-[(phenylmethyl)amino]methyl]-propan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[benzylcarbamoyl(propan-2-yl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[benzylcarbamoyl(isopropyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC(C)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4S/c1-19(2)29(26(31)27-14-20-7-4-3-5-8-20)17-25(30)28(16-22-9-6-12-34-22)15-21-10-11-23-24(13-21)33-18-32-23/h3-13,19H,14-18H2,1-2H3,(H,27,31)