1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-(3-ethoxypropyl)thiourea Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NN=C(C)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCOCCCNC(=S)N/N=C(/C)\C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C17H25N3O3S/c1-3-21-9-4-8-18-17(24)20-19-13(2)14-6-7-15-16(12-14)23-11-5-10-22-15/h6-7,12H,3-5,8-11H2,1-2H3,(H2,18,20,24)/b19-13-