1-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-4-methyl-1,3-thiazol-2-yl]-3-phenyl-urea

Systemtic Name: 1-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-4-methyl-1,3-thiazol-2-yl]-3-phenyl-urea Openeye Name: 1-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-carbonyl]-4-methyl-thiazol-2-yl]-3-phenyl-urea CAS Name: 1-[5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]-oxomethyl]-4-methyl-2-thiazolyl]-3-phenylurea IUPAC Name: 1-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-carbonyl]-4-methyl-1,3-thiazol-2-yl]-3-phenylurea Traditional Name: 1-[4-methyl-5-(4-piperonylpiperazin-4-ium-1-carbonyl)thiazol-2-yl]-3-phenyl-urea Formula: C24H26N5O4S+ MolecularWeight: 480.55934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NC2=CC=CC=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NC2=CC=CC=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H25N5O4S/c1-16-21(34-24(25-16)27-23(31)26-18-5-3-2-4-6-18)22(30)29-11-9-28(10-12-29)14-17-7-8-19-20(13-17)33-15-32-19/h2-8,13H,9-12,14-15H2,1H3,(H2,25,26,27,31)/p+1