1-(furan-2-ylmethyl)-3-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2-furylmethyl)-3-[2-methyl-5-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(2-furanylmethyl)-3-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-(2-methyl-5-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(2-furfuryl)-3-(2-methyl-5-piperidinosulfonyl-phenyl)thiourea Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NCC3=CC=CO3

InChI

InChI=1S/C18H23N3O3S2/c1-14-7-8-16(26(22,23)21-9-3-2-4-10-21)12-17(14)20-18(25)19-13-15-6-5-11-24-15/h5-8,11-12H,2-4,9-10,13H2,1H3,(H2,19,20,25)