1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-p-anisyl-thiourea Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H20N2O3S/c1-21-15-6-3-13(4-7-15)12-19-18(24)20-14-5-8-16-17(11-14)23-10-2-9-22-16/h3-8,11H,2,9-10,12H2,1H3,(H2,19,20,24)