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

Systemtic Name: 1-cyclopropyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea Openeye Name: 1-cyclopropyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea CAS Name: 1-cyclopropyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea IUPAC Name: 1-cyclopropyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea Traditional Name: 1-cyclopropyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=S)NC3CC3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=S)NC3CC3)OC1

InChI

InChI=1S/C13H16N2O2S/c18-13(14-9-2-3-9)15-10-4-5-11-12(8-10)17-7-1-6-16-11/h4-5,8-9H,1-3,6-7H2,(H2,14,15,18)