1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-homoveratryl-thiourea Formula: C18H25BrN4O2S MolecularWeight: 441.3857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCCNC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=NN(C=C1Br)CCCNC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H25BrN4O2S/c1-13-15(19)12-23(22-13)10-4-8-20-18(26)21-9-7-14-5-6-16(24-2)17(11-14)25-3/h5-6,11-12H,4,7-10H2,1-3H3,(H2,20,21,26)