1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethyl]-3-phenyl-thiourea

Systemtic Name: 1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethyl]-3-phenyl-thiourea Openeye Name: 1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]ethyl]-3-phenyl-thiourea CAS Name: 1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidinyl]ethyl]-3-phenylthiourea IUPAC Name: 1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethyl]-3-phenylthiourea Traditional Name: 1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]ethyl]-3-phenyl-thiourea Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC(=S)NC2=CC=CC=C2)CC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1CCNC(=S)NC2=CC=CC=C2)CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C23H29N3O2S/c29-23(25-19-6-2-1-3-7-19)24-13-10-18-11-14-26(15-12-18)16-20-17-27-21-8-4-5-9-22(21)28-20/h1-9,18,20H,10-17H2,(H2,24,25,29)