1-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-1-[3-(3-methylpiperidin-1-yl)propyl]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-1-[3-(3-methylpiperidin-1-yl)propyl]thiourea Openeye Name: 1-(2-furylmethyl)-3-(3-methoxyphenyl)-1-[3-(3-methyl-1-piperidyl)propyl]thiourea CAS Name: 1-(2-furanylmethyl)-3-(3-methoxyphenyl)-1-[3-(3-methyl-1-piperidinyl)propyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-1-[3-(3-methylpiperidin-1-yl)propyl]thiourea Traditional Name: 1-(2-furfuryl)-3-(3-methoxyphenyl)-1-[3-(3-methylpiperidino)propyl]thiourea Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCN(CC2=CC=CO2)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1CCCN(C1)CCCN(CC2=CC=CO2)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H31N3O2S/c1-18-7-4-11-24(16-18)12-6-13-25(17-21-10-5-14-27-21)22(28)23-19-8-3-9-20(15-19)26-2/h3,5,8-10,14-15,18H,4,6-7,11-13,16-17H2,1-2H3,(H,23,28)