1-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-(3-methoxyphenyl)urea

Systemtic Name: 1-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]-3-(3-methoxyphenyl)urea CAS Name: 1-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-(3-methoxyphenyl)urea Traditional Name: 1-(3-methoxyphenyl)-3-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]urea Formula: C25H32N4O5 MolecularWeight: 468.54538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C25H32N4O5/c1-17(2)23(27-25(31)26-19-5-4-6-20(14-19)32-3)24(30)29-11-9-28(10-12-29)15-18-7-8-21-22(13-18)34-16-33-21/h4-8,13-14,17,23H,9-12,15-16H2,1-3H3,(H2,26,27,31)