1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-ethylphenyl)thiourea

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-ethylphenyl)thiourea Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-ethylphenyl)thiourea CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-ethylphenyl)thiourea IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-ethylphenyl)thiourea Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-ethylphenyl)thiourea Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H20N2O2S/c1-2-13-5-3-6-14(11-13)19-18(23)20-15-7-8-16-17(12-15)22-10-4-9-21-16/h3,5-8,11-12H,2,4,9-10H2,1H3,(H2,19,20,23)