1-methyl-1-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-methyl-1-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-methyl-1-[[5-(phenoxymethyl)furan-2-carbonyl]amino]thiourea CAS Name: 1-methyl-1-[[oxo-[5-(phenoxymethyl)-2-furanyl]methyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-methyl-1-[[5-(phenoxymethyl)furan-2-carbonyl]amino]thiourea Traditional Name: 3-benzyl-1-methyl-1-[[5-(phenoxymethyl)-2-furoyl]amino]thiourea Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)NC(=O)C2=CC=C(O2)COC3=CC=CC=C3

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)NC(=O)C2=CC=C(O2)COC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-24(21(28)22-14-16-8-4-2-5-9-16)23-20(25)19-13-12-18(27-19)15-26-17-10-6-3-7-11-17/h2-13H,14-15H2,1H3,(H,22,28)(H,23,25)