3-(1H-benzimidazol-2-ylmethyl)-1-(furan-2-ylmethyl)-1-(1-piperidin-1-ylethyl)thiourea

Systemtic Name: 3-(1H-benzimidazol-2-ylmethyl)-1-(furan-2-ylmethyl)-1-(1-piperidin-1-ylethyl)thiourea Openeye Name: 3-(1H-benzimidazol-2-ylmethyl)-1-(2-furylmethyl)-1-[1-(1-piperidyl)ethyl]thiourea CAS Name: 3-(1H-benzimidazol-2-ylmethyl)-1-(2-furanylmethyl)-1-[1-(1-piperidinyl)ethyl]thiourea IUPAC Name: 3-(1H-benzimidazol-2-ylmethyl)-1-(furan-2-ylmethyl)-1-(1-piperidin-1-ylethyl)thiourea Traditional Name: 3-(1H-benzimidazol-2-ylmethyl)-1-(2-furfuryl)-1-(1-piperidinoethyl)thiourea Formula: C21H27N5OS MolecularWeight: 397.53698

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCCC1)N(CC2=CC=CO2)C(=S)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(N1CCCCC1)N(CC2=CC=CO2)C(=S)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H27N5OS/c1-16(25-11-5-2-6-12-25)26(15-17-8-7-13-27-17)21(28)22-14-20-23-18-9-3-4-10-19(18)24-20/h3-4,7-10,13,16H,2,5-6,11-12,14-15H2,1H3,(H,22,28)(H,23,24)