1-[(3-bromophenyl)methyl]-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[(3-bromophenyl)methyl]-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-[(3-bromophenyl)methyl]-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-[(3-bromophenyl)methyl]-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[(3-bromophenyl)methyl]-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-(3-bromobenzyl)-3-(3,4-dimethoxyphenyl)thiourea Formula: C16H17BrN2O2S MolecularWeight: 381.28738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NCC2=CC(=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NCC2=CC(=CC=C2)Br)OC

InChI

InChI=1S/C16H17BrN2O2S/c1-20-14-7-6-13(9-15(14)21-2)19-16(22)18-10-11-4-3-5-12(17)8-11/h3-9H,10H2,1-2H3,(H2,18,19,22)