3-(3-methoxypropyl)-1-methyl-1-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]thiourea

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[(E)-1-oxo-3-(3-phenoxyphenyl)prop-2-enyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[[(E)-3-(3-phenoxyphenyl)acryloyl]amino]thiourea Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C=CC1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)/C=C/C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O3S/c1-24(21(28)22-14-7-15-26-2)23-20(25)13-12-17-8-6-11-19(16-17)27-18-9-4-3-5-10-18/h3-6,8-13,16H,7,14-15H2,1-2H3,(H,22,28)(H,23,25)/b13-12+