3-(3-chloranyl-2-methyl-phenyl)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-ethyl-thiourea

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-ethyl-thiourea Openeye Name: 3-(3-chloro-2-methyl-phenyl)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-ethyl-thiourea CAS Name: 3-(3-chloro-2-methylphenyl)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-ethylthiourea IUPAC Name: 3-(3-chloro-2-methylphenyl)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-ethylthiourea Traditional Name: 3-(3-chloro-2-methyl-phenyl)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-ethyl-thiourea Formula: C19H21ClN2O2S MolecularWeight: 376.90024

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)C(=S)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CCN(C[C@H]1COC2=CC=CC=C2O1)C(=S)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C19H21ClN2O2S/c1-3-22(19(25)21-16-8-6-7-15(20)13(16)2)11-14-12-23-17-9-4-5-10-18(17)24-14/h4-10,14H,3,11-12H2,1-2H3,(H,21,25)/t14-/m0/s1