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

Systemtic Name: 1-cyclohexyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea Openeye Name: 1-cyclohexyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea CAS Name: 1-cyclohexyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea IUPAC Name: 1-cyclohexyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea Traditional Name: 1-cyclohexyl-3-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]thiourea Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1CCCCC1)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C/C(=N/NC(=S)NC1CCCCC1)/C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H25N3O2S/c1-13(20-21-18(24)19-15-6-3-2-4-7-15)14-8-9-16-17(12-14)23-11-5-10-22-16/h8-9,12,15H,2-7,10-11H2,1H3,(H2,19,21,24)/b20-13-