1-cyclopentyl-3-[[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]amino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]amino]thiourea Openeye Name: 1-cyclopentyl-3-[[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]prop-2-enoyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[(E)-3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]acryloyl]amino]thiourea Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=CC(=O)NNC(=S)NC3CCCC3)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C/C(=O)NNC(=S)NC3CCCC3)O[C@H](C2)C

InChI

InChI=1S/C20H27N3O3S/c1-3-25-17-12-15-10-13(2)26-18(15)11-14(17)8-9-19(24)22-23-20(27)21-16-6-4-5-7-16/h8-9,11-13,16H,3-7,10H2,1-2H3,(H,22,24)(H2,21,23,27)/b9-8+/t13-/m0/s1