1-[3-[4-(1,3-benzodioxol-5-ylsulfinyl)piperidin-1-yl]carbonyl-7-methoxy-1-benzothiophen-2-yl]-3-ethyl-urea

Systemtic Name: 1-[3-[4-(1,3-benzodioxol-5-ylsulfinyl)piperidin-1-yl]carbonyl-7-methoxy-1-benzothiophen-2-yl]-3-ethyl-urea Openeye Name: 1-[3-[4-(1,3-benzodioxol-5-ylsulfinyl)piperidine-1-carbonyl]-7-methoxy-benzothiophen-2-yl]-3-ethyl-urea CAS Name: 1-[3-[[4-(1,3-benzodioxol-5-ylsulfinyl)-1-piperidinyl]-oxomethyl]-7-methoxy-1-benzothiophen-2-yl]-3-ethylurea IUPAC Name: 1-[3-[4-(1,3-benzodioxol-5-ylsulfinyl)piperidine-1-carbonyl]-7-methoxy-1-benzothiophen-2-yl]-3-ethylurea Traditional Name: 1-[3-[4-(1,3-benzodioxol-5-ylsulfinyl)piperidine-1-carbonyl]-7-methoxy-benzothiophen-2-yl]-3-ethyl-urea Formula: C25H27N3O6S2 MolecularWeight: 529.62838

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=C(C2=C(S1)C(=CC=C2)OC)C(=O)N3CCC(CC3)S(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCNC(=O)NC1=C(C2=C(S1)C(=CC=C2)OC)C(=O)N3CCC(CC3)S(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H27N3O6S2/c1-3-26-25(30)27-23-21(17-5-4-6-19(32-2)22(17)35-23)24(29)28-11-9-15(10-12-28)36(31)16-7-8-18-20(13-16)34-14-33-18/h4-8,13,15H,3,9-12,14H2,1-2H3,(H2,26,27,30)