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

Systemtic Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea CAS Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC=C)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

C/C(=N/NC(=S)NCC=C)/C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C15H19N3O2S/c1-3-7-16-15(21)18-17-11(2)12-5-6-13-14(10-12)20-9-4-8-19-13/h3,5-6,10H,1,4,7-9H2,2H3,(H2,16,18,21)/b17-11-