1-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-(3-methylbutyl)thiourea Openeye Name: 1-isopentyl-3-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-[[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-isoamyl-3-[[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]amino]thiourea Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)NNC(=S)NCCC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)NNC(=S)NCCC(C)C

InChI

InChI=1S/C17H25N3O2S/c1-12(2)9-10-18-17(23)20-19-16(21)8-6-14-11-13(3)5-7-15(14)22-4/h5-8,11-12H,9-10H2,1-4H3,(H,19,21)(H2,18,20,23)/b8-6+