1-ethyl-3-[3-[4-(3-methoxyphenyl)sulfonylpiperazin-1-yl]carbonyl-1-benzothiophen-2-yl]urea

Systemtic Name: 1-ethyl-3-[3-[4-(3-methoxyphenyl)sulfonylpiperazin-1-yl]carbonyl-1-benzothiophen-2-yl]urea Openeye Name: 1-ethyl-3-[3-[4-(3-methoxyphenyl)sulfonylpiperazine-1-carbonyl]benzothiophen-2-yl]urea CAS Name: 1-ethyl-3-[3-[[4-(3-methoxyphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-benzothiophen-2-yl]urea IUPAC Name: 1-ethyl-3-[3-[4-(3-methoxyphenyl)sulfonylpiperazine-1-carbonyl]-1-benzothiophen-2-yl]urea Traditional Name: 1-ethyl-3-[3-[4-(3-methoxyphenyl)sulfonylpiperazine-1-carbonyl]benzothiophen-2-yl]urea Formula: C23H26N4O5S2 MolecularWeight: 502.60634

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)OC

Isomeric SMILES

CCNC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)OC

InChI

InChI=1S/C23H26N4O5S2/c1-3-24-23(29)25-21-20(18-9-4-5-10-19(18)33-21)22(28)26-11-13-27(14-12-26)34(30,31)17-8-6-7-16(15-17)32-2/h4-10,15H,3,11-14H2,1-2H3,(H2,24,25,29)