1-[2-(3-bromanyl-4-methoxy-phenyl)ethanoylamino]-3-[[4-(2-methylpropoxy)phenyl]methyl]thiourea

Systemtic Name: 1-[2-(3-bromanyl-4-methoxy-phenyl)ethanoylamino]-3-[[4-(2-methylpropoxy)phenyl]methyl]thiourea Openeye Name: 1-[[2-(3-bromo-4-methoxy-phenyl)acetyl]amino]-3-[(4-isobutoxyphenyl)methyl]thiourea CAS Name: 1-[[2-(3-bromo-4-methoxyphenyl)-1-oxoethyl]amino]-3-[[4-(2-methylpropoxy)phenyl]methyl]thiourea IUPAC Name: 1-[[2-(3-bromo-4-methoxyphenyl)acetyl]amino]-3-[[4-(2-methylpropoxy)phenyl]methyl]thiourea Traditional Name: 1-[[2-(3-bromo-4-methoxy-phenyl)acetyl]amino]-3-(4-isobutoxybenzyl)thiourea Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CNC(=S)NNC(=O)CC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CNC(=S)NNC(=O)CC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C21H26BrN3O3S/c1-14(2)13-28-17-7-4-15(5-8-17)12-23-21(29)25-24-20(26)11-16-6-9-19(27-3)18(22)10-16/h4-10,14H,11-13H2,1-3H3,(H,24,26)(H2,23,25,29)