N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methoxyphenyl)carbamoyl-propan-2-yl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methoxyphenyl)carbamoyl-propan-2-yl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[isopropyl-[(4-methoxyphenyl)carbamoyl]amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(4-methoxyanilino)-oxomethyl]-propan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methoxyphenyl)carbamoyl-propan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[isopropyl-[(4-methoxyphenyl)carbamoyl]amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C26H29N3O5S MolecularWeight: 495.59056

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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)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H29N3O5S/c1-18(2)29(26(31)27-20-7-9-21(32-3)10-8-20)16-25(30)28(15-22-5-4-12-35-22)14-19-6-11-23-24(13-19)34-17-33-23/h4-13,18H,14-17H2,1-3H3,(H,27,31)