1-[(3-chloranyl-4-methyl-phenyl)methyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea

Systemtic Name: 1-[(3-chloranyl-4-methyl-phenyl)methyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Openeye Name: 1-[(3-chloro-4-methyl-phenyl)methyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-[(3-chloro-4-methylphenyl)methyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea IUPAC Name: 1-[(3-chloro-4-methylphenyl)methyl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Traditional Name: 1-(3-chloro-4-methyl-benzyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C17H17ClN2O2S MolecularWeight: 348.84708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)OCCO3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)OCCO3)Cl

InChI

InChI=1S/C17H17ClN2O2S/c1-11-2-3-12(8-14(11)18)10-19-17(23)20-13-4-5-15-16(9-13)22-7-6-21-15/h2-5,8-9H,6-7,10H2,1H3,(H2,19,20,23)