1-[4-[4-(1,3-benzodioxol-4-yl)piperazin-1-yl]butyl]-1-(1-benzothiophen-2-yl)urea

Systemtic Name: 1-[4-[4-(1,3-benzodioxol-4-yl)piperazin-1-yl]butyl]-1-(1-benzothiophen-2-yl)urea Openeye Name: 1-[4-[4-(1,3-benzodioxol-4-yl)piperazin-1-yl]butyl]-1-(benzothiophen-2-yl)urea CAS Name: 1-[4-[4-(1,3-benzodioxol-4-yl)-1-piperazinyl]butyl]-1-(1-benzothiophen-2-yl)urea IUPAC Name: 1-[4-[4-(1,3-benzodioxol-4-yl)piperazin-1-yl]butyl]-1-(1-benzothiophen-2-yl)urea Traditional Name: 1-[4-[4-(1,3-benzodioxol-4-yl)piperazino]butyl]-1-(benzothiophen-2-yl)urea Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN(C2=CC3=CC=CC=C3S2)C(=O)N)C4=C5C(=CC=C4)OCO5

Isomeric SMILES

C1CN(CCN1CCCCN(C2=CC3=CC=CC=C3S2)C(=O)N)C4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C24H28N4O3S/c25-24(29)28(22-16-18-6-1-2-9-21(18)32-22)11-4-3-10-26-12-14-27(15-13-26)19-7-5-8-20-23(19)31-17-30-20/h1-2,5-9,16H,3-4,10-15,17H2,(H2,25,29)