1-(3,4-dimethylphenyl)-3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[(E)-3-(2-furyl)prop-2-enoyl]amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[(E)-3-(2-furyl)acryloyl]amino]thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C=CC2=CC=CO2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)/C=C/C2=CC=CO2)C

InChI

InChI=1S/C16H17N3O2S/c1-11-5-6-13(10-12(11)2)17-16(22)19-18-15(20)8-7-14-4-3-9-21-14/h3-10H,1-2H3,(H,18,20)(H2,17,19,22)/b8-7+