3-(5-chloranyl-2-methoxy-phenyl)-1-(furan-2-ylmethyl)-1-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-(furan-2-ylmethyl)-1-[(4-methylphenyl)methyl]thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1-(2-furylmethyl)-1-(p-tolylmethyl)thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-(2-furanylmethyl)-1-[(4-methylphenyl)methyl]thiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1-(furan-2-ylmethyl)-1-[(4-methylphenyl)methyl]thiourea Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-1-(2-furfuryl)-1-(4-methylbenzyl)thiourea Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC=CO2)C(=S)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC=CO2)C(=S)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H21ClN2O2S/c1-15-5-7-16(8-6-15)13-24(14-18-4-3-11-26-18)21(27)23-19-12-17(22)9-10-20(19)25-2/h3-12H,13-14H2,1-2H3,(H,23,27)