3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methylfuran-2-yl)methyl]thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methylfuran-2-yl)methyl]thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methyl-2-furyl)methyl]thiourea CAS Name: 3-(2,5-dimethylphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(5-methyl-2-furanyl)methyl]thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methylfuran-2-yl)methyl]thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methyl-2-furyl)methyl]thiourea Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(O3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(O3)C

InChI

InChI=1S/C21H26N4OS/c1-16-5-6-17(2)20(13-16)23-21(27)25(14-19-8-7-18(3)26-19)11-4-10-24-12-9-22-15-24/h5-9,12-13,15H,4,10-11,14H2,1-3H3,(H,23,27)