3-(4-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methylfuran-2-yl)methyl]thiourea

Systemtic Name: 3-(4-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methylfuran-2-yl)methyl]thiourea Openeye Name: 3-(4-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methyl-2-furyl)methyl]thiourea CAS Name: 3-(4-ethoxyphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(5-methyl-2-furanyl)methyl]thiourea IUPAC Name: 3-(4-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(5-methylfuran-2-yl)methyl]thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-1-[(5-methyl-2-furyl)methyl]-3-p-phenetyl-thiourea Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(O3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(O3)C

InChI

InChI=1S/C21H26N4O2S/c1-3-26-19-9-6-18(7-10-19)23-21(28)25(15-20-8-5-17(2)27-20)13-4-12-24-14-11-22-16-24/h5-11,14,16H,3-4,12-13,15H2,1-2H3,(H,23,28)