1-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[1-(2-benzyloxyethyl)pyrazol-4-yl]thiourea CAS Name: 1-[1-(2-phenylmethoxyethyl)-4-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[1-(2-benzoxyethyl)pyrazol-4-yl]thiourea Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=CN(N=C1)CCOCC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)NC1=CN(N=C1)CCOCC2=CC=CC=C2

InChI

InChI=1S/C16H20N4OS/c1-2-8-17-16(22)19-15-11-18-20(12-15)9-10-21-13-14-6-4-3-5-7-14/h2-7,11-12H,1,8-10,13H2,(H2,17,19,22)