1-(1-benzothiophen-3-yl)-1-[4-[4-(3,4-dihydro-2H-chromen-8-yl)piperazin-1-yl]butyl]urea

Systemtic Name: 1-(1-benzothiophen-3-yl)-1-[4-[4-(3,4-dihydro-2H-chromen-8-yl)piperazin-1-yl]butyl]urea Openeye Name: 1-(benzothiophen-3-yl)-1-[4-(4-chroman-8-ylpiperazin-1-yl)butyl]urea CAS Name: 1-(1-benzothiophen-3-yl)-1-[4-[4-(3,4-dihydro-2H-1-benzopyran-8-yl)-1-piperazinyl]butyl]urea IUPAC Name: 1-(1-benzothiophen-3-yl)-1-[4-[4-(3,4-dihydro-2H-chromen-8-yl)piperazin-1-yl]butyl]urea Traditional Name: 1-(benzothiophen-3-yl)-1-[4-(4-chroman-8-ylpiperazino)butyl]urea Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=CC=C2)N3CCN(CC3)CCCCN(C4=CSC5=CC=CC=C54)C(=O)N)OC1

Isomeric SMILES

C1CC2=C(C(=CC=C2)N3CCN(CC3)CCCCN(C4=CSC5=CC=CC=C54)C(=O)N)OC1

InChI

InChI=1S/C26H32N4O2S/c27-26(31)30(23-19-33-24-11-2-1-9-21(23)24)13-4-3-12-28-14-16-29(17-15-28)22-10-5-7-20-8-6-18-32-25(20)22/h1-2,5,7,9-11,19H,3-4,6,8,12-18H2,(H2,27,31)