1-(furan-2-ylmethyl)-1-(3-piperidin-1-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-1-(3-piperidin-1-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea Openeye Name: 1-(2-furylmethyl)-1-[3-(1-piperidyl)propyl]-3-(2,4,6-trimethylphenyl)thiourea CAS Name: 1-(2-furanylmethyl)-1-[3-(1-piperidinyl)propyl]-3-(2,4,6-trimethylphenyl)thiourea IUPAC Name: 1-(furan-2-ylmethyl)-1-(3-piperidin-1-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea Traditional Name: 1-(2-furfuryl)-3-mesityl-1-(3-piperidinopropyl)thiourea Formula: C23H33N3OS MolecularWeight: 399.59262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)N(CCCN2CCCCC2)CC3=CC=CO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)N(CCCN2CCCCC2)CC3=CC=CO3)C

InChI

InChI=1S/C23H33N3OS/c1-18-15-19(2)22(20(3)16-18)24-23(28)26(17-21-9-7-14-27-21)13-8-12-25-10-5-4-6-11-25/h7,9,14-16H,4-6,8,10-13,17H2,1-3H3,(H,24,28)